SCHEMBL11388917

SCHEMBL11388917

CCc1cc(C(CCl)c2cc(CC)c(OC)c(CC)c2)cc(CC)c1OC

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.35
▸ TAAR1 Q96RJ0 2/20 0.33
▸ DHFR P00374 2/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ CYP2C9 P11712 2/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ MAPT P10636 1/20 0.30

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
SCHEMBL11356073 0.83 THRB (0.38) PTGS2L3MBTL1MAPT
SCHEMBL11358154 0.81 PTGS2 (0.35) PTGS2TAAR1DHFRL3MBTL1HTR2A
SCHEMBL11357376 0.81 PTGS2 (0.35) PTGS2TAAR1DHFRL3MBTL1HTR2A
SCHEMBL21547572 0.78 TAAR1 (0.40) PTGS2TAAR1DHFRL3MBTL1HTR2A
SCHEMBL11357143 0.76 GABRA1 (0.41) DHFRCYP2C9
SCHEMBL11360628 0.76 TUBB4A (0.37) DHFR
SCHEMBL11354627 0.75 IMPDH2 (0.36) PTGS2TAAR1DHFR
SCHEMBL12325395 0.72 PTGS2 (0.44) PTGS2TAAR1DHFRHTR2AMAPT
SCHEMBL11354770 0.72 PTGS2 (0.39) PTGS2DHFRHTR2A
SCHEMBL21547605 0.70 PTGS2 (0.60) PTGS2TAAR1DHFRHTR2AMAPT

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
EP-0001910-B1 PREPARATION OF 4,4'-DIHYDROXY STILBENES OR DERIVATIVES THEREOF MONSANTO COMPANY (US) 1981-09-02 — — EP disclosed
US-4189610-A Preparation of 4,4-dioxy-substituted stilbenes MONSANTO COMPANY (US) 1980-02-19 — — US disclosed
EP-0001910-A1 Preparation of 4,4'-dihydroxy stilbenes or derivatives thereof MONSANTO COMPANY (US) 1979-05-16 — — EP disclosed
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