SCHEMBL2408682

SCHEMBL2408682

Nc1c(C(=O)O)ccc(Cl)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.52
CASP7 P55210 2/20 0.48
G6PD P11413 1/20 0.48
CASP6 P55212 1/20 0.48
ALDH1A1 P00352 7/20 0.45
TSHR P16473 3/20 0.45
CASP1 P29466 2/20 0.45
TP53 P04637 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 5/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HSD17B10 Q99714 3/20 0.44
RXFP1 Q9HBX9 1/20 0.44
MAPT P10636 5/20 0.44
AKR1C2 P52895 2/20 0.44
AKR1C1 Q04828 2/20 0.44
CYP3A4 P08684 2/20 0.44
AKR1C4 P17516 1/20 0.44
AKR1C3 P42330 1/20 0.44

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
SCHEMBL29941102 1.00 DPP4 (0.52) DPP4CASP7G6PDCASP6ALDH1A1
SCHEMBL9276248 0.84 MAPT (0.39) DPP4CASP7G6PDCASP6ALDH1A1
SCHEMBL10316048 0.83 ALDH1A1 (0.49) DPP4CASP7G6PDCASP6ALDH1A1
SCHEMBL18980394 0.83 ALDH1A1 (0.48) DPP4CASP7G6PDCASP6ALDH1A1
SCHEMBL29860864 0.82 SELL (0.56) CASP7G6PDCASP6ALDH1A1TSHR
SCHEMBL26963264 0.82 SELL (0.56) CASP7G6PDCASP6ALDH1A1TSHR
SCHEMBL3667246 0.81 TSHR (0.52) DPP4CASP7G6PDCASP6ALDH1A1
SCHEMBL10533170 0.80 SELL (0.60) DPP4ALDH1A1TSHRCASP1TP53
SCHEMBL7697637 0.78 SELL (0.64) CASP7G6PDCASP6ALDH1A1TSHR
SCHEMBL4069345 0.78 DPP4 (0.56) DPP4ALDH1A1TSHRCASP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007054348-A1 NOVEL MEDICAMENTS Ernst-Moritz-Arndt-Universität Greifswald (DE) 2007-05-18 WO claimed
CN-1076439-A The new derivative of 3-hydroxyanthranilic acid, Preparation Method And The Use ASTRA AB (SE) 1993-09-22 CN claimed
US-20240122887-A1 THERAPEUTIC USES OF L-4-CHLOROKYNURENINE VISTAGEN THERAPEUTICS, INC. (US) 2024-04-18 US disclosed
EP-4108239-A1 THERAPEUTIC USES OF L-4-CHLOROKYNURENINE Vistagen Therapeutics, Inc. (US) 2022-12-28 EP disclosed
EP-3297619-B1 THERAPEUTIC USES OF L-4-CHLOROKYNURENINE VISTAGEN THERAPEUTICS INC (US) 2022-07-06 EP disclosed
US-11078544-B2 Method for identifying subjects with aggressive melanoma skin cancer at diagnosis UNIVERSITEIT MAASTRICHT (NL) 2021-08-03 US disclosed
US-20190321317-A1 THERAPEUTIC USES OF L-4-CHLOROKYNURENINE VISTAGEN THERAPEUTICS, INC. (US) 2019-10-24 US disclosed
US-20190256926-A1 METHOD FOR IDENTIFYING SUBJECTS WITH AGGRESSIVE MELANOMA SKIN CANCER AT DIAGNOSIS MLA DIAGNOSTICS B.V. (NL) 2019-08-22 US disclosed
US-10260109-B2 Method for identifying subjects with aggressive melanoma skin cancer at diagnosis UNIVERSITEIT MAASTRICHT (NL) 2019-04-16 US disclosed
EP-3303625-B1 METHOD FOR IDENTIFYING SUBJECTS WITH AGGRESSIVE MELANOMA SKIN CANCER AT DIAGNOSIS UNIV MAASTRICHT (NL) 2019-03-27 EP disclosed
US-20180305298-A1 DEUTERATED CHLOROKYNURENINES FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS CEPHALON, INC. 2018-10-25 US disclosed
CN-1121344-A New compounds ASTRA AB (SE) 1996-04-24 CN disclosed
EP-0686145-A1 NEW COMPOUNDS AKTIEBOLAGET ASTRA (SE) 1995-12-13 EP disclosed
EP-0686144-A1 NEW COMPOUNDS Astra Aktiebolag (SE) 1995-12-13 EP disclosed
EP-0643686-A1 NEW COMPOUNDS Astra Aktiebolag (SE) 1995-03-22 EP disclosed
WO-1994019316-A1 NEW COMPOUNDS AKTIEBOLAGET ASTRA (SE) 1994-09-01 WO disclosed
WO-1994019315-A1 NEW COMPOUNDS ASTRA AKTIEBOLAG (SE) 1994-09-01 WO disclosed
CN-1076439-A The new derivative of 3-hydroxyanthranilic acid, Preparation Method And The Use ASTRA AB (SE) 1993-09-22 CN disclosed
WO-1993005012-A1 NEW COMPOUNDS AB ASTRA (SE) 1993-03-18 WO disclosed
EP-0530166-A2 3-Hydroxy anthranilic acid derivatives for inhibiting 3-hydroxy anthranilate oxygenase Astra Aktiebolag (SE) 1993-03-03 EP 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 (1 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-20180305298-A1 DEUTERATED CHLOROKYNURENINES FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS GRIK3, GRIK1, GRIK2 DPP4 2644/4885CASP7 4464/4885G6PD 2829/4885

“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.