SCHEMBL5032930

SCHEMBL5032930

Oc1ccc2ccc3c(O)[c]ccc3c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.37
ESR1 P03372 5/20 0.36
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.34
PDE2A O00408 1/20 0.34
ESR2 Q92731 4/20 0.34
CDK4 P11802 2/20 0.34
CCND1 P24385 2/20 0.34
RAD52 P43351 1/20 0.34
ALOX15 P16050 2/20 0.33
HSD17B10 Q99714 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP3A4 P08684 2/20 0.33
CYP19A1 P11511 1/20 0.33
CYP17A1 P05093 1/20 0.33
CYP11B1 P15538 1/20 0.33

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
SCHEMBL5034862 0.89 CYP1A2 (0.39) ESR1LMNACYP1A2ESR2ALOX15
SCHEMBL5031460 0.86 MCL1 (0.40) MCL1ESR1LMNACYP1A2ESR2
SCHEMBL5034793 0.78 CYP1A2 (0.38) ESR1LMNACYP1A2ESR2ALOX15
SCHEMBL2145668 0.76
SCHEMBL670670 0.76 CYP1A2 (0.52) MCL1ESR1LMNACYP1A2ESR2
SCHEMBL6369167 0.72 CYP1A2 (0.50) MCL1ESR1LMNACYP1A2ESR2
SCHEMBL26132517 0.71 HPRT1 (0.64) MCL1CYP1A2CDK4CCND1HSD17B10
SCHEMBL14809442 0.71 HPRT1 (0.64) MCL1CYP1A2CDK4CCND1HSD17B10
Methane SCHEMBL27725823 0.69 HPRT1 (0.61) MCL1CYP1A2CDK4CCND1HSD17B10
SCHEMBL17131781 0.68 HSD17B10 (0.52) ESR1LMNACYP1A2PDE2AESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080262127-A1 FLAME RESISTANT RESIN COMPOSITION CHANG CHUN PLASTICS CO., LTD. (TW) 2008-10-23 US disclosed