SCHEMBL11355693

SCHEMBL11355693

CCc1cc(C(CI)c2cc(CC)c(OC)c(C)c2C)c(C)c(C)c1OC

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ IMPDH2 P12268 7/20 0.35
▸ PTGS2 P35354 1/20 0.32
▸ CNR2 P34972 1/20 0.31
▸ GPR55 Q9Y2T6 1/20 0.31
▸ TAAR1 Q96RJ0 1/20 0.30
▸ DHFR P00374 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
SCHEMBL11354328 0.87 TSHR (0.33) —
SCHEMBL11354627 0.83 IMPDH2 (0.36) IMPDH2PTGS2CNR2GPR55TAAR1
SCHEMBL11357985 0.83 IMPDH2 (0.36) IMPDH2PTGS2CNR2GPR55TAAR1
SCHEMBL11358553 0.81 ALDH1A1 (0.34) —
SCHEMBL11350488 0.76 GABRA1 (0.32) —
SCHEMBL11406929 0.75 ALDH1A1 (0.31) PTGS2
SCHEMBL11357376 0.75 PTGS2 (0.35) PTGS2TAAR1DHFR
SCHEMBL11354429 0.72 TAAR1 (0.50) TAAR1
SCHEMBL11410906 0.72 KDM4E (0.32) —
SCHEMBL11355764 0.70 THRB (0.35) —

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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