SCHEMBL11358154

SCHEMBL11358154

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

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.35
▸ TAAR1 Q96RJ0 2/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TPMT P51580 2/20 0.33
▸ DHFR P00374 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ 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
SCHEMBL11347822 0.83 THRB (0.38) PTGS2HSD17B10L3MBTL1ALDH1A1POLB
SCHEMBL11388917 0.81 PTGS2 (0.35) PTGS2TAAR1DHFRL3MBTL1HTR2A
SCHEMBL11357376 0.81 PTGS2 (0.35) PTGS2TAAR1DHFRL3MBTL1HTR2A
SCHEMBL21547572 0.78 TAAR1 (0.40) PTGS2TAAR1DHFRL3MBTL1MAPK1
SCHEMBL11354323 0.76 ALDH1A1 (0.37) HSD17B10TPMTDHFRALDH1A1
SCHEMBL11355106 0.76 GABRA1 (0.41) DHFRALDH1A1
SCHEMBL11357985 0.75 IMPDH2 (0.36) PTGS2TAAR1HSD17B10DHFRALDH1A1
SCHEMBL6736591 0.73 HSD17B10 (0.42) PTGS2TAAR1HSD17B10DHFRMAPT
SCHEMBL1573216 0.72 TPMT (0.52) PTGS2HSD17B10TPMTL3MBTL1ALDH1A1
SCHEMBL12325395 0.72 PTGS2 (0.44) PTGS2TAAR1DHFRALDH1A1HTR2A

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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