SCHEMBL3028647

SCHEMBL3028647

CC(C)(C)OC(=O)C(N)Cc1cccc(O)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 5/20 0.56
GRIA2 P42262 1/20 0.52
LTA4H P09960 1/20 0.44
TYR P14679 1/20 0.44
NOS3 P29474 1/20 0.42
NOS1 P29475 1/20 0.42
NOS2 P35228 1/20 0.42
ENPP2 Q13822 1/20 0.41
CYP3A4 P08684 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18788872 1.00 SLC7A5 (0.56) SLC7A5GRIA2LTA4HTYRNOS3
SCHEMBL27525604 0.86 SLC7A5 (0.56) SLC7A5GRIA2LTA4HNOS3NOS1
SCHEMBL18481474 0.86 SLC7A5 (0.56) SLC7A5GRIA2LTA4HNOS3NOS1
SCHEMBL10561230 0.84 SLC7A5 (0.55) SLC7A5LTA4HNOS3NOS1NOS2
SCHEMBL30475895 0.84 SLC7A5 (0.55) SLC7A5
SCHEMBL17978075 0.84 SLC7A5 (0.55) SLC7A5LTA4HNOS3NOS1NOS2
SCHEMBL27350860 0.84 SLC7A5 (0.55) SLC7A5LTA4HNOS3NOS1NOS2
SCHEMBL10561439 0.84 SLC7A5 (0.55) SLC7A5
SCHEMBL19664048 0.84 SLC7A5 (0.55) SLC7A5
SCHEMBL10560530 0.84 SLC7A5 (0.55) SLC7A5LTA4HNOS3NOS1NOS2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12162902-B2 Decarboxylase inhibitors for treating Parkinson's disease SAIL BIOMEDICINES (US) 2024-12-10 US disclosed
US-20230181493-A1 BIOMARKERS RELATED TO PARKINSON'S DISEASE AND METHODS OF USING THE SAME SENDA BIOSCIENCES INC (US) 2023-06-15 US disclosed
US-20220048849-A1 DECARBOXYLASE INHIBITORS FOR TREATING PARKINSON'S DISEASE SENDA BIOSCIENCES, INC. 2022-02-17 US disclosed
EP-3891122-A1 DECARBOXYLASE INHIBITORS FOR TREATING PARKINSON'S DISEASE Senda Biosciences, Inc. (US) 2021-10-13 EP disclosed
CN-113302176-A Decarboxylase inhibitors for the treatment of parkinson's disease 先达生物科技公司 2021-08-24 CN disclosed
WO-2020118163-A1 DECARBOXYLASE INHIBITORS FOR TREATING PARKINSON'S DISEASE KINTAI THERAPEUTICS, INC. (US) 2020-06-11 WO disclosed
US-10259800-B2 Method of fluorination using iodonium ylides THE GENERAL HOSPITAL CORPORATION (US) 2019-04-16 US disclosed
EP-2155663-B1 SUBSTITUTED 2-[2-(PHENYL)ETHYLAMINO]ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS NEWRON PHARM SPA (IT) 2017-11-29 EP disclosed
US-20170121300-A1 METHOD OF FLUORINATION USING IODONIUM YLIDES THE GENERAL HOSPITAL CORPORATION 2017-05-04 US disclosed
US-9603832-B2 Substituted 2-[2-(phenyl) ethylamino]alkaneamide derivatives and their use as sodium and/or calcium channel modulators NEWRON PHARMACEUTICALS S.P.A. (IT) 2017-03-28 US disclosed
US-20150157600-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS NEWRON PHARMACEUTICALS S.P.A. (IT) 2015-06-11 US disclosed
US-20150157602-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS NEWRON PHARMACEUTICALS S.P.A. (IT) 2015-06-11 US disclosed
US-20150157598-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS NEWRON PHARMACEUTICALS S.P.A. (IT) 2015-06-11 US disclosed
US-9051240-B2 Substituted 2-[2-(phenyl) ethylamino] alkaneamide derivatives and their use as sodium and/or calcium channel modulators NEWRON PHARMACEUTICALS S.P.A. (IT) 2015-06-09 US disclosed
US-20130289122-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS NEWRON PHARMACEUTICALS S.P.A (IT) 2013-10-31 US disclosed
US-20130274249-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS NEWRON PHARMACEUTICALS S.P.A (IT) 2013-10-17 US disclosed
US-8519000-B2 Substituted 2-[2-(phenyl) ethylamino] alkaneamide derivatives and their use as sodium and/or calcium channel modulators NEWRON PHARMACEUTICALS S.P.A. (IT) 2013-08-27 US disclosed
US-20100210631-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-08-19 US disclosed
EP-2155663-A1 SUBSTITUTED 2- Ý2- (PHENYL) ETHYLAMINO¨ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS Newron Pharmaceuticals S.p.A. (IT) 2010-02-24 EP disclosed
WO-2008151702-A1 SUBSTITUTED 2- [2- (PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS NEWRON PHARMACEUTICALS S.P.A. (IT) 2008-12-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170121300-A1 METHOD OF FLUORINATION USING IODONIUM YLIDES FLI1, ABL1, PFAS SLC7A5 642/4885GRIA2 4312/4885LTA4H 2343/4885
US-20130274249-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS CACNA1A, CACNA1B, SARAF SLC7A5 2477/4885GRIA2 104/4885LTA4H 900/4885
US-20150157598-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS CACNA1A, CACNA1E, CACNA1S SLC7A5 2140/4885GRIA2 114/4885LTA4H 1643/4885
US-20100210631-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS CACNA1A, CACNA1B, SARAF SLC7A5 2513/4885GRIA2 111/4885LTA4H 918/4885
US-12162902-B2 Decarboxylase inhibitors for treating Parkinson's disease DDC, DDT, DDO SLC7A5 966/4885GRIA2 1339/4885LTA4H 1572/4885
US-20130289122-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS CACNA1A, CACNA1B, SARAF SLC7A5 2477/4885GRIA2 104/4885LTA4H 900/4885
US-20150157600-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS CACNA1A, CACNA1E, CACNA1S SLC7A5 2140/4885GRIA2 114/4885LTA4H 1643/4885
US-20150157602-A1 SUBSTITUTED 2-[2-(PHENYL) ETHYLAMINO] ALKANEAMIDE DERIVATIVES AND THEIR USE AS SODIUM AND/OR CALCIUM CHANNEL MODULATORS CACNA1A, CACNA1E, CACNA1S SLC7A5 2140/4885GRIA2 114/4885LTA4H 1643/4885
US-10259800-B2 Method of fluorination using iodonium ylides FLI1, ABL1, PFAS SLC7A5 642/4885GRIA2 4312/4885LTA4H 2343/4885
US-20220048849-A1 DECARBOXYLASE INHIBITORS FOR TREATING PARKINSON'S DISEASE DDC, DDT, DDO SLC7A5 966/4885GRIA2 1339/4885LTA4H 1572/4885
US-20230181493-A1 BIOMARKERS RELATED TO PARKINSON'S DISEASE AND METHODS OF USING THE SAME COMT, SNCA, PARK7 SLC7A5 4540/4885GRIA2 1560/4885LTA4H 2821/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.