SCHEMBL8828409

SCHEMBL8828409

CC(=O)Nc1ccc(/C=C/CC(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.58
MAPT P10636 5/20 0.55
KMT2A Q03164 3/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
MEN1 O00255 2/20 0.55
MAPK1 P28482 1/20 0.55
MAOB P27338 1/20 0.53
PPARG P37231 1/20 0.49
GAA P10253 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NAPRT Q6XQN6 1/20 0.48
HSD17B10 Q99714 1/20 0.48
NOX1 Q9Y5S8 1/20 0.48
TAAR1 Q96RJ0 1/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 2/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL8828415 1.00 PAM (0.58) PAMMAPTKMT2ANPC1RAB9A
SCHEMBL9213867 0.84 PAM (0.54) PAMMAPTKMT2ANPC1RAB9A
SCHEMBL14476694 0.83 HPGD (0.54) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL10944710 0.82 SMN1; SMN2 (0.64) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL7941715 0.82 SMN1; SMN2 (0.64) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL7941711 0.82 SMN1; SMN2 (0.64) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL9210792 0.81 PAM (0.51) PAMMAPTKMT2ARAB9AMEN1
Hydrochloric Acid SCHEMBL11475753 0.80 MAPT (0.51) MAPTKMT2ANPC1RAB9AMEN1
Hydrochloric Acid SCHEMBL11475755 0.80 MAPT (0.51) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL9213200 0.79 KDM4C (0.49) PAMMAPTKMT2ARAB9AMEN1

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
US-5607953-A ANTIISCHEMIC AGENTS EISAI CO., LTD. (JP) 1997-03-04 US disclosed
EP-0344577-B1 Butenoic or propenoic acid derivatives EISAI CO LTD (JP) 1996-10-09 EP disclosed
US-5430059-A Treating heart disease EISAI CO., LTD. (JP) 1995-07-04 US disclosed
EP-0399358-B1 Butenoic acid derivatives EISAI CO LTD (JP) 1995-03-08 EP disclosed
US-5382595-A Antiischemic agents EISAI CO., LTD. (JP) 1995-01-17 US disclosed
EP-0633248-A1 Butenoic acid derivatives Eisai Co., Ltd. (JP) 1995-01-11 EP disclosed
EP-0589491-A1 Butenoic acid derivatives Eisai Co., Ltd. (JP) 1994-03-30 EP disclosed
US-5292770-A Butenoic acid derivatives EISAI CO., LTD. (JP) 1994-03-08 US disclosed
US-5177089-A Antiischemic agent, vasodilator EISAI CO., LTD. (JP) 1993-01-05 US disclosed
US-5166188-A Cardiovascular disorders, antiischemic agents EISAI CO., LTD. (JP) 1992-11-24 US disclosed
EP-0399358-A2 Butenoic acid derivatives Eisai Co., Ltd. (JP) 1990-11-28 EP disclosed
EP-0344577-A2 Butenoic or propenoic acid derivatives Eisai Co., Ltd. (JP) 1989-12-06 EP disclosed