SCHEMBL7656355

SCHEMBL7656355

COc1ccc2c(=O)cc(-c3ccc(Cl)cc3)oc2c1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.83
CYP3A4 P08684 6/20 0.75
TP53 P04637 5/20 0.75
KDM4E B2RXH2 5/20 0.75
ALDH1A1 P00352 5/20 0.75
HPGD P15428 5/20 0.75
HSD17B10 Q99714 4/20 0.75
MAPT P10636 4/20 0.75
MEN1 O00255 3/20 0.75
CYP2C9 P11712 3/20 0.75
CYP2C19 P33261 3/20 0.75
KMT2A Q03164 3/20 0.75
CYP2D6 P10635 2/20 0.75
TNKS O95271 4/20 0.74
CYP19A1 P11511 1/20 0.74
KCNA5 P22460 2/20 0.73
KCNH2 Q12809 2/20 0.73
GABRP O00591 1/20 0.73
GABRD O14764 1/20 0.73
GABRA1 P14867 1/20 0.73

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
SCHEMBL30674795 1.00 MAOB (0.83) MAOBCYP3A4TP53KDM4EALDH1A1
4,7-Dimethoxyflavone SCHEMBL3470601 0.91 MAOB (1.00) MAOBCYP3A4TP53KDM4EALDH1A1
SCHEMBL312254 0.86 CYP3A4 (1.00) MAOBCYP3A4TP53KDM4EALDH1A1
SCHEMBL30674786 0.86 MAOB (1.00) MAOBCYP3A4TP53KDM4EALDH1A1
SCHEMBL30266579 0.86 CYP3A4 (1.00) MAOBCYP3A4TP53KDM4EALDH1A1
SCHEMBL9142214 0.86 MAOB (1.00) MAOBCYP3A4TP53KDM4EALDH1A1
7-Methoxyflavone SCHEMBL1373009 0.85 TNKS (1.00) MAOBCYP3A4TP53KDM4EALDH1A1
SCHEMBL13169589 0.84 GABRP (1.00) MAOBCYP3A4TP53KDM4EALDH1A1
SCHEMBL31238410 0.83 TNKS (0.84) MAOBCYP3A4TP53KDM4EALDH1A1
SCHEMBL30000774 0.83 MAOB (0.74) MAOBCYP3A4TP53KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1109800-A1 NOVEL CDK INHIBITORS HAVING FLAVONE STRUCTURE LG CHEMICAL LIMITED (KR) 2001-06-27 EP claimed
WO-2000012496-A1 NOVEL CDK INHIBITORS HAVING FLAVONE STRUCTURE LG CHEMICAL LTD. (KR) 2000-03-09 WO claimed
US-6500846-B1 2-(4-CHLOROPHENYL)-7-METHOXYCHROMEN-4-ONE, AS CYCLIN-DEPENDENT KINASE INHIBITORS, USED AS ANTICARCINOGENIC AGENTS OR FOR PROPHYLAXIS OF NEURODEGENERATIVE DISEASE LG CHEMICAL, LTD. (KR) 2002-12-31 US disclosed
EP-1109800-A1 NOVEL CDK INHIBITORS HAVING FLAVONE STRUCTURE LG CHEMICAL LIMITED (KR) 2001-06-27 EP disclosed
WO-2000012496-A1 NOVEL CDK INHIBITORS HAVING FLAVONE STRUCTURE LG CHEMICAL LTD. (KR) 2000-03-09 WO disclosed