SCHEMBL2227906

SCHEMBL2227906

CC(C)(CCCN)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.54
ACACB O00763 1/20 0.52
ACACA Q13085 1/20 0.52
ODC1 P11926 2/20 0.48
LMNA P02545 2/20 0.45
BLM P54132 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
PMP22 Q01453 1/20 0.45
PPARA Q07869 4/20 0.41
CYP1A2 P05177 2/20 0.40
TSHR P16473 2/20 0.40
GABRR3 A8MPY1 1/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
HDAC3 O15379 1/20 0.40
GABBR2 O75899 1/20 0.40
THRB P10828 1/20 0.40

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
Hydrochloric Acid SCHEMBL3506267 0.98 ACLY (0.52) ACLYACACBACACAODC1LMNA
SCHEMBL9718212 0.93 ACLY (0.57) ACLYACACBACACAODC1LMNA
SCHEMBL10870768 0.91 ACLY (0.61) ACLYACACBACACAODC1LMNA
SCHEMBL10869894 0.91 ACLY (0.61) ACLYACACBACACAODC1LMNA
SCHEMBL9350070 0.91 ACLY (0.61) ACLYACACBACACAODC1LMNA
SCHEMBL28439734 0.91 ACLY (0.61) ACLYACACBACACAODC1LMNA
SCHEMBL10870280 0.91 ACLY (0.61) ACLYACACBACACAODC1LMNA
SCHEMBL10548846 0.88 ACLY (0.52) ACLYACACBACACAODC1LMNA
SCHEMBL205335 0.84
SCHEMBL2784372 0.84 ACLY (0.62) ACLYACACBACACASMN1; SMN2PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240368150-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2024-11-07 US disclosed
EP-4291558-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES FOR THE TREATMENT OF CANCER F. Hoffmann-La Roche AG (CH) 2023-12-20 EP disclosed
CN-116964048-A Bicyclic tetrahydroazepine derivatives for the treatment of cancer 豪夫迈·罗氏有限公司 2023-10-27 CN disclosed
CN-113474390-B Polyurethane for cosmetic and process for producing polyurethane for cosmetic 株式会社ADEKA 2023-10-17 CN disclosed
CN-111808084-A Novel lipids and compositions for delivery of therapeutic agents 阿布特斯生物制药公司 2020-10-23 CN disclosed
CN-101693736-B Novel peptides 寒川贤治 2020-09-11 CN disclosed
CN-105709229-B Novel lipids and compositions for delivery of therapeutic agents 阿布特斯生物制药公司 2020-07-28 CN disclosed
US-9938332-B2 Modified ghrelin peptides Kanagawa, Kenji (JP) 2018-04-10 US disclosed
US-9573986-B2 Modified ghrelin peptides KENJI KANGAWA (JP) 2017-02-21 US disclosed
EP-2834220-B1 4-HYDROXY-ISOQUINOLINE COMPOUNDS AS HIF HYDROXYLASE INHIBITORS FIBROGEN INC (US) 2016-11-09 EP disclosed
EP-2119785-A1 Novel peptides Kangawa, Kenji (JP) 2009-11-18 EP disclosed
US-20090170763-A1 Modified gherlin peptides KANGAWA KENJI 2009-07-02 US disclosed
US-7385026-B1 Modified ghrelin polypeptides Kangawa, Kenji (JP) 2008-06-10 US disclosed
WO-2008034122-A2 HINDERED ESTER-BASED BIODEGRADABLE LINKERS FOR OLIGONUCLEOTIDE DELIVERY ENZON PHARMACEUTICALS, INC. (US) 2008-03-20 WO disclosed
EP-1197496-B1 NOVEL PEPTIDES KANGAWA KENJI (JP) 2007-07-11 EP disclosed
EP-1795598-A1 Novel peptides Kangawa, Kenji (JP) 2007-06-13 EP disclosed
CN-1458842-A Cell activator SHISEIDO CO LTD (JP) 2003-11-26 CN disclosed
EP-1197496-A1 NOVEL PEPTIDES Kangawa, Kenji (JP) 2002-04-17 EP disclosed
EP-0774247-A2 Hair care products Ajinomoto Co., Inc. (JP) 1997-05-21 EP disclosed
EP-0186083-A2 N-(2-Hyxdroxyalkyl)-amino acids and their derivatives, process for their preparation and pharmaceutical compositions containing them ASTA Pharma AG (DE) 1986-07-02 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 (2 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-20090170763-A1 Modified gherlin peptides GHSR, GHRHR, GHITM ACLY 4381/4885ACACB 4530/4885ACACA 4491/4885
US-20240368150-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES FOR THE TREATMENT OF CANCER BICRA, BRD4, CNR1 ACLY 1040/4885ACACB 3004/4885ACACA 2645/4885

“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.