SCHEMBL7655891

SCHEMBL7655891

COc1ccc2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc2c1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 2/20 0.67
▸ TERT O14746 4/20 0.66
▸ ADORA3 P0DMS8 1/20 0.62
▸ ABCG2 Q9UNQ0 3/20 0.61
▸ ABCB1 P08183 2/20 0.61
▸ KDM4E B2RXH2 5/20 0.58
▸ MEN1 O00255 5/20 0.58
▸ MAPT P10636 5/20 0.58
▸ KMT2A Q03164 5/20 0.58
▸ ALDH1A1 P00352 4/20 0.58
▸ TP53 P04637 4/20 0.58
▸ CYP3A4 P08684 4/20 0.58
▸ HPGD P15428 4/20 0.58
▸ HSD17B10 Q99714 4/20 0.58
▸ ALOX15 P16050 4/20 0.58
▸ LMNA P02545 3/20 0.58
▸ CASP1 P29466 3/20 0.58
▸ CASP7 P55210 3/20 0.58
▸ MAPK1 P28482 3/20 0.58
▸ NOX4 Q9NPH5 1/20 0.58

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
SCHEMBL34929 0.90 APP (0.67) APPTERTADORA3ABCG2ABCB1
SCHEMBL30117602 0.86 APP (0.73) APPTERTADORA3KDM4EMEN1
SCHEMBL34972 0.85 TERT (0.76) APPTERTADORA3KDM4EMEN1
SCHEMBL31682973 0.85 TERT (0.76) APPTERTADORA3KDM4EMEN1
SCHEMBL31682991 0.81 APP (1.00) APPTERTADORA3KDM4EMEN1
SCHEMBL10067898 0.81 ADORA3 (0.71) APPADORA3ABCG2ABCB1KDM4E
SCHEMBL35096 0.81 APP (1.00) APPTERTADORA3KDM4EMEN1
SCHEMBL35304 0.80 APP (0.84) APPTERTABCG2ABCB1KDM4E
SCHEMBL6613454 0.80 TERT (1.00) TERTMAPTALDH1A1CYP3A4HPGD
SCHEMBL14259664 0.80 TUBB4A (0.70) APPADORA3ABCG2ABCB1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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