SCHEMBL7657022

SCHEMBL7657022

COc1cccc2oc(C3=COC(Cc4ccccc4)O3)c(O)c(=O)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
MEN1 O00255 4/20 0.43
CYP3A4 P08684 4/20 0.43
KMT2A Q03164 4/20 0.43
HPGD P15428 3/20 0.43
HSD17B10 Q99714 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MAOA P21397 2/20 0.42
NQO1 P15559 1/20 0.41
LMNA P02545 3/20 0.41
TP53 P04637 3/20 0.41
MAPT P10636 3/20 0.41
ALOX15 P16050 2/20 0.41
USP2 O75604 1/20 0.41
MAPK1 P28482 1/20 0.41
ESR1 P03372 1/20 0.40
KDM5A P29375 1/20 0.40
ESR2 Q92731 1/20 0.40
PPARG P37231 2/20 0.38
ABCG2 Q9UNQ0 2/20 0.38

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
SCHEMBL7661015 0.85 MAOA (0.43) KDM4EMEN1CYP3A4KMT2AHPGD
SCHEMBL7660104 0.80 ADORA3 (0.48) KDM4EMEN1CYP3A4KMT2AHPGD
SCHEMBL7654424 0.80 KDM4E (0.54) KDM4EMEN1CYP3A4KMT2AHPGD
SCHEMBL7655719 0.79 MAOA (0.44) KDM4EMEN1CYP3A4KMT2AHPGD
SCHEMBL7660027 0.77 NQO1 (0.46) KDM4EMEN1CYP3A4KMT2AHSD17B10
SCHEMBL7666098 0.76 MAPT (0.58) KDM4EMEN1CYP3A4KMT2AHPGD
SCHEMBL7651988 0.76 KDM4E (0.41) KDM4EMEN1CYP3A4KMT2AHPGD
SCHEMBL7656081 0.76 MAPT (0.48) KDM4EMEN1CYP3A4KMT2AHSD17B10
SCHEMBL31675988 0.75 KDM4E (0.67) KDM4EMEN1CYP3A4KMT2AHPGD
SCHEMBL4649646 0.75 KDM4E (0.67) KDM4EMEN1CYP3A4KMT2AHPGD

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