SCHEMBL542279

SCHEMBL542279

NC(CNC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.65
SLC1A3 P43003 1/20 0.65
LMNA P02545 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HTT P42858 1/20 0.54
CA12 O43570 2/20 0.51
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA9 Q16790 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
PLAU P00749 1/20 0.50
DPP8 Q6V1X1 1/20 0.50
DPP7 Q9UHL4 1/20 0.50
ALPI P09923 1/20 0.50
PKM P14618 1/20 0.50
PTGS1 P23219 1/20 0.50
XIAP P98170 1/20 0.50
SLC7A5 Q01650 1/20 0.50
SYK P43405 1/20 0.49
SLC6A2 P23975 1/20 0.49

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
SCHEMBL7375139 1.00 SLC1A1 (0.65) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL10705141 1.00 SLC1A1 (0.65) SLC1A1SLC1A3LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL383365 0.98 SLC1A1 (0.64) SLC1A1SLC1A3LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL7355918 0.98 SLC1A1 (0.64) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL29398484 0.91 SLC1A3 (0.58) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL14381151 0.89 SLC1A3 (0.56) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL14335621 0.88 SLC1A3 (0.55) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL7243772 0.88 SLC1A3 (0.55) SLC1A1SLC1A3LMNASMN1; SMN2HTT
SCHEMBL5019077 0.87 LMNA (0.59) SLC1A1SLC1A3LMNASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL7243767 0.87 SLC1A3 (0.54) SLC1A1SLC1A3LMNASMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832076-A1 NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-04-01 EP claimed
CN-117510352-A Synthesis method of D-2, 3-diaminopropionic acid 浙江永太科技股份有限公司 2024-02-06 CN disclosed
US-9957292-B2 Compositions and methods for modulating angiopoietin-like 3 expression IONIS PHARMACEUTICALS, INC. (US) 2018-05-01 US disclosed
EP-2415766-A1 METHOD FOR MANUFACTURING BENZODIAZEPINE DERIVATIVE Zeria Pharmaceutical Co., Ltd. (JP) 2012-02-08 EP disclosed
US-20120010401-A1 METHOD FOR MANUFACTURING 1,5-BENZODIAZEPINE DERIVATIVE ZERIA PHARMACEUTICAL CO., LTD. (JP) 2012-01-12 US disclosed
CN-100379718-C N alpha-Boc-N beta-Cbz-L-2,3 diaminopropionic acid derivative synthesis method UNIV WUHAN (CN) 2008-04-09 CN disclosed
EP-1135374-B9 BENZIMIDAZOLE COMPOUNDS THAT ARE VITRONECTIN RECEPTOR ANTAGONISTS SCHERING CORP (US) 2007-02-21 EP disclosed
EP-1135374-B1 BENZIMIDAZOLE COMPOUNDS THAT ARE VITRONECTIN RECEPTOR ANTAGONISTS SCHERING CORP (US) 2006-09-06 EP disclosed
EP-0945445-B9 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARM CO LTD (JP) 2005-12-28 EP disclosed
EP-0945445-B1 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARM CO LTD (JP) 2003-09-03 EP disclosed
WO-1994008608-A1 AMINO ACID CONJUGATES OF CYCLOHEXAPEPTIDYL AMINES MERCK & CO., INC. (US) 1994-04-28 WO disclosed
EP-0293071-B1 REDOX AMINO ACIDS AND PEPTIDES CONTAINING THEM UNIVERSITY OF FLORIDA (US) 1993-09-01 EP disclosed
WO-1993012138-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING HIV INFECTIONS SCHERING CORPORATION (US) 1993-06-24 WO disclosed
US-5079366-A To derivatize pharmaceutical peptides for transport across the blood/brain barrier UNIVERSITY OF FLORIDA (US) 1992-01-07 US disclosed
US-4888427-A DIHYDROPYRIDINE-PYRIDINIUM SALT REDOX SYSTEM UNIVERSITY OF FLORIDA (US) 1989-12-19 US disclosed
EP-0293071-A1 Redox amino acids and peptides containing them UNIVERSITY OF FLORIDA (US) 1988-11-30 EP disclosed
EP-0083923-B1 AMINOACYL-CONTAINING DIPEPTIDE DERIVATIVES USEFUL AS ANTIHYPERTENSIVES MERCK & CO. INC. (US) 1988-10-19 EP disclosed
US-4555502-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS MERCK & CO., INC. (US) 1985-11-26 US disclosed
EP-0083923-A2 Aminoacyl-containing dipeptide derivatives useful as antihypertensives MERCK & CO. INC. (US) 1983-07-20 EP disclosed
EP-0009728-A1 Hemostatic and platelet increasing agent containing alpha, beta-diaminopropionic acid and derivatives thereof Hokuriku Pharmaceutical Co.,Ltd (JP) 1980-04-16 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-20120010401-A1 METHOD FOR MANUFACTURING 1,5-BENZODIAZEPINE DERIVATIVE GABRA5, CYP3A5, GABRA1 SLC1A1 1472/4885SLC1A3 1768/4885LMNA 2944/4885

“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.