SCHEMBL7318040

SCHEMBL7318040

O=Cc1ccc(-n2ccc(=O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.50
TRIM24 O15164 1/20 0.45
TRIM33 Q9UPN9 1/20 0.45
ALDH1A1 P00352 9/20 0.44
KDM4E B2RXH2 5/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KCNJ1 P48048 1/20 0.41
CYP2A6 P11509 3/20 0.39
HSD17B10 Q99714 1/20 0.39
ALDH5A1 P51649 1/20 0.39
ABAT P80404 1/20 0.39
TYR P14679 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
SCHEMBL835187 0.82 ALDH1A1 (0.52) TRIM24TRIM33ALDH1A1KDM4EMAPK1
SCHEMBL2511973 0.73 KCNJ1 (0.53) TRIM24TRIM33ALDH1A1KDM4EMAPK1
SCHEMBL20176617 0.73 KMT2A (0.53) KMT2AKDM4ESMN1; SMN2CYP2A6HSD17B10
SCHEMBL20649339 0.73 KMT2A (0.59) KMT2AALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL92862 0.73 KMT2A (0.59) KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL10434353 0.73 KMT2A (0.53) KMT2AKDM4ESMN1; SMN2
SCHEMBL7319404 0.72 KMT2A (0.52) KMT2AALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL8507327 0.71 MGLL (0.68) TRIM24TRIM33ALDH1A1MAPK1
SCHEMBL14077258 0.71 RELA (0.40) KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL8288350 0.71 MAPT (0.60) KMT2AALDH1A1KDM4EMAPK1SMN1; SMN2

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 17 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
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-5246928-A Cardiovascular disorders SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-09-21 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
US-5066653-A Cardiovascular disorders; bronchodilators; phosphodiesterase inhibitors SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1991-11-19 US disclosed
EP-0399358-A2 Butenoic acid derivatives Eisai Co., Ltd. (JP) 1990-11-28 EP disclosed
CN-1009092-B The preparation method of Pyridione derivatives SMITH KLINE FRENCH LAB (GB) 1990-08-08 CN disclosed
US-4906628-A N-phenylpyridone type III phosphodiesterases SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1990-03-06 US disclosed
EP-0344577-A2 Butenoic or propenoic acid derivatives Eisai Co., Ltd. (JP) 1989-12-06 EP disclosed
CN-86106546-A The preparation method of Pyridione derivatives 1987-05-20 CN disclosed
EP-0220044-A2 4(4-oxo-1,4-dihydropyridin-1-yl)phenyl derivatives SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1987-04-29 EP disclosed