SCHEMBL7889798

SCHEMBL7889798

CCOC(=O)c1nc(SC)[nH]c1C(=O)OCC

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.48
ALDH1A1 P00352 5/20 0.47
HPGD P15428 3/20 0.47
HTT P42858 2/20 0.47
RECQL P46063 1/20 0.47
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
GAA P10253 1/20 0.42
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.40
HSD17B10 Q99714 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 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
SCHEMBL7885587 0.87 ALDH1A1 (0.45) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL4754864 0.87 KDM4E (0.55) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL6469855 0.85 KDM4E (0.49) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL9292094 0.84 ALDH1A1 (0.43) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL7885220 0.81 ALDH1A1 (0.51) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL7878648 0.80 KDM4E (0.43) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL9293148 0.80 GPR84 (0.48) ALDH1A1HTTCYP1A2CYP2C9CYP2C19
SCHEMBL3205024 0.78 ALDH1A1 (0.49) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL7309272 0.78 ALDH1A1 (0.49) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL7885491 0.78 ALDH1A1 (0.49) KDM4EALDH1A1HPGDHTTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0573218-B1 4-Carboxyimidazoles as angiotensin II antagonists and their thrapeutic use SANKYO CO (JP) 2001-03-07 EP disclosed
US-5646171-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1997-07-08 US disclosed
US-5616599-A HYPOTENSIVE AGENTS FOR CARDIOVASCULAR DISORDER SANKYO COMPANY, LIMITED (JP) 1997-04-01 US disclosed
EP-0313724-B1 Bis (acyloxymethyl) imidazole Derivative UNIV NEW YORK STATE RES FOUND (US) 1995-08-09 EP disclosed
US-5329012-A Bactericides, fungicides or antitumor agents THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1994-07-12 US disclosed
EP-0573218-A2 4-Carboxyimidazoles as angiotensin II antagonists and their thrapeutic use SANKYO COMPANY LIMITED (JP) 1993-12-08 EP disclosed
EP-0313724-A2 Bis (acyloxymethyl) imidazole Derivative THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1989-05-03 EP disclosed