SCHEMBL8828153

SCHEMBL8828153

O=Cc1ccc(-c2ccc(=O)[nH]n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.62
KMT2A Q03164 2/20 0.62
MEN1 O00255 1/20 0.62
CYP1A2 P05177 3/20 0.61
PDE3B Q13370 5/20 0.53
PDE3A Q14432 5/20 0.53
MAPT P10636 1/20 0.50
PDE4A P27815 3/20 0.49
PDE4B Q07343 3/20 0.49
PDE4C Q08493 3/20 0.49
PDE4D Q08499 3/20 0.49
HRH3 Q9Y5N1 6/20 0.44
KCNH2 Q12809 1/20 0.44
CYP2C9 P11712 2/20 0.41
HPGD P15428 2/20 0.41
CYP2C19 P33261 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL3452908 0.86 LMNA (0.80) LMNAKMT2AMEN1CYP1A2PDE3B
SCHEMBL9687063 0.79 LMNA (0.69) LMNAKMT2AMEN1CYP1A2PDE3B
SCHEMBL11119158 0.77 LMNA (0.57) LMNAKMT2AMEN1CYP1A2PDE3B
SCHEMBL1392640 0.77 LMNA (0.67) LMNAKMT2AMEN1CYP1A2PDE3B
SCHEMBL11035831 0.77 LMNA (1.00) LMNAKMT2AMEN1CYP1A2PDE3B
SCHEMBL4122238 0.77 LMNA (0.67) LMNAKMT2AMEN1CYP1A2PDE3B
SCHEMBL2152989 0.77 LMNA (0.67) LMNAKMT2AMEN1CYP1A2PDE3B
SCHEMBL928226 0.77 LMNA (0.67) LMNAKMT2AMEN1CYP1A2PDE3B
SCHEMBL928205 0.77 LMNA (0.67) LMNAKMT2AMEN1CYP1A2PDE3B
SCHEMBL481916 0.77 LMNA (0.67) LMNAKMT2AMEN1CYP1A2PDE3B

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
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-5382595-A Antiischemic agents EISAI CO., LTD. (JP) 1995-01-17 US disclosed
US-5177089-A Antiischemic agent, vasodilator EISAI CO., LTD. (JP) 1993-01-05 US disclosed
US-5047417-A Butenoic or propenoic acid derivatives EISAI CO. LTD. (JP) 1991-09-10 US disclosed
CN-1040366-A Butenoic acid or acrylic acid derivative EISAI CO LTD (JP) 1990-03-14 CN disclosed
EP-0344577-A2 Butenoic or propenoic acid derivatives Eisai Co., Ltd. (JP) 1989-12-06 EP disclosed