SCHEMBL7915978

SCHEMBL7915978

Cc1cc(C(C)(c2cccc(C(C)(c3ccc(O)c(C)c3)c3ccc(O)c(C)c3)c2)c2ccc(O)c(C)c2)ccc1O

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 14/20 0.81
ESR2 Q92731 10/20 0.81
AR P10275 3/20 0.53
TDP1 Q9NUW8 2/20 0.46
TP53 P04637 1/20 0.46
HSD17B1 P14061 2/20 0.44
HSD17B2 P37059 2/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PDE10A Q9Y233 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL9298912 0.91 ESR1 (0.74) ESR1ESR2ARTDP1TP53
SCHEMBL217305 0.91 ESR1 (0.80) ESR1ESR2ARTDP1TP53
SCHEMBL29465776 0.91 ESR1 (0.80) ESR1ESR2ARTDP1TP53
SCHEMBL29471727 0.91 ESR1 (0.80) ESR1ESR2ARTDP1TP53
SCHEMBL29720626 0.90 ESR1 (1.00) ESR1ESR2ARTDP1TP53
SCHEMBL835556 0.90 ESR1 (1.00) ESR1ESR2ARTDP1TP53
SCHEMBL697802 0.88 ESR1 (0.83) ESR1ESR2ARTDP1TP53
SCHEMBL29696059 0.88 ESR1 (0.83) ESR1ESR2ARTDP1TP53
SCHEMBL13617608 0.85 ESR1 (0.71) ESR1ESR2ARTDP1TP53
SCHEMBL31463334 0.85 ESR1 (0.71) ESR1ESR2ARTDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4514334-A Polyphenolic compounds GENERAL ELECTRIC COMPANY (US) 1985-04-30 US claimed
US-6222004-B1 MOLDABILITY IN BLOW MOLDING; APPEARANCE AND COLOR TONE IDEMITSU PETROCHEMICAL CO., LTD (JP) 2001-04-24 US disclosed
EP-1035151-A1 BRANCHED POLYCARBONATE RESIN Idemitsu Petrochemical Co., Ltd. (JP) 2000-09-13 EP disclosed
US-4514334-A Polyphenolic compounds GENERAL ELECTRIC COMPANY (US) 1985-04-30 US disclosed