SCHEMBL9836292

SCHEMBL9836292

COC(=O)C[C@@H]1CC(=O)N1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 2/20 0.59
ITGA5 P08648 2/20 0.59
ITGB3 P05106 1/20 0.59
ITGB2 P05107 1/20 0.59
ITGAV P06756 1/20 0.59
ITGA2B P08514 1/20 0.59
ITGB5 P18084 1/20 0.59
ITGAL P20701 1/20 0.59
BRD4 O60885 2/20 0.46
GAA P10253 2/20 0.45
EGFR P00533 1/20 0.37
KMT2A Q03164 1/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
CREBBP Q92793 1/20 0.35
MIF P14174 4/20 0.35
HDAC6 Q9UBN7 1/20 0.35

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
SCHEMBL10968083 1.00 ITGB1 (0.59) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL9836299 1.00 ITGB1 (0.59) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL10999787 0.87 ITGB1 (0.53) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL9377695 0.82 ITGB1 (0.61) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL11307625 0.81 ITGB1 (0.55) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL21565414 0.79 GAA (0.41) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL21565344 0.79 GAA (0.41) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL21565345 0.79 GAA (0.41) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL11062751 0.77
SCHEMBL10104800 0.75 GAA (0.39) ITGB1ITGA5ITGB3ITGB2ITGAV

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-58198492-A None JP disclosed
EP-0197491-B1 3-OXO-2-AZABICYCLOHEXANE DERIVATIVES, PROCESS FOR THE PRODUCTION THEREOF AND USE OF SAID DERIVATIVES AS INTERMEDIATES FOR ANTIBACTERIAL AGENTS Eisai Co., Ltd. (JP) 1991-12-27 EP disclosed
US-4754029-A 3-oxo-2-azabicyclohexane derivatives EISAI CO., LTD. (JP) 1988-06-28 US disclosed
EP-0197491-A1 3-oxo-2-azabicyclohexane derivatives, process for the production thereof and use of said derivatives as intermediates for antibacterial agents Eisai Co., Ltd. (JP) 1986-10-15 EP disclosed
US-4511509-A CARBAPENICILLIN INTERMEDIATES KOWA CO. LTD. (JP) 1985-04-16 US disclosed
US-4506085-A AMINATION, INTERMEDIATE FOR ANTIBIOTICS SANRAKU-OCEAN CO., LTD. (JP) 1985-03-19 US disclosed
EP-0051234-B1 A PROCESS FOR THE PRODUCTION OF A 2-AZETIDINONE DERIVATIVE ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1985-03-13 EP disclosed
EP-0050799-B1 NEW PROCESSES FOR THE PRODUCTION OF DI-ALKYL ESTERS AND OPTICALLY ACTIVE MONO-ALKYL ESTERS OF 3-AMINOGLUTARIC ACID ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1984-12-19 EP disclosed
JP-S58198492-A NOVEL AZETIDINE DERIVATIVE AND ITS PREPARATION KOWA CO 1983-11-18 JP disclosed
EP-0091239-A1 Azetidine derivatives and a process for their production KOWA COMPANY, LTD. (JP) 1983-10-12 EP disclosed
EP-0090340-A1 Process for preparation of optically active 4-(2-Hydroxyethyl)-2-azetidinone KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1983-10-05 EP disclosed
EP-0050799-A1 New processes for the production of di-alkyl esters and optically active mono-alkyl esters of 3-aminoglutaric acid ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1982-05-05 EP disclosed