SCHEMBL11353495

SCHEMBL11353495

COc1ccc(C(CI)c2ccc(OC)cc2Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 5/20 0.42
▸ HTR2A P28223 4/20 0.42
▸ KCNH2 Q12809 3/20 0.42
▸ BCHE P06276 1/20 0.38
▸ TYR P14679 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ ADRA2A P08913 1/20 0.37
▸ ADRA1A P35348 1/20 0.37
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ MRGPRX4 Q96LA9 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ HSP90AB1 P08238 1/20 0.36
▸ CA12 O43570 2/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ CA7 P43166 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ CA14 Q9ULX7 2/20 0.35

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
SCHEMBL11356278 0.84 NQO1 (0.43) TDP1ALDH1A1
SCHEMBL11358146 0.84 SLC6A4 (0.43) SLC6A4HTR2AKCNH2BCHETYR
SCHEMBL11385852 0.82 SLC6A4 (0.42) SLC6A4HTR2AKCNH2BCHETYR
SCHEMBL11360637 0.80 TYR (0.39) HTR2ABCHETYRACHEADRA2A
SCHEMBL11407371 0.80 HTT (0.41) BCHETYRACHEADRA2AADRA1A
SCHEMBL11349697 0.80 BCHE (0.39) HTR2ABCHETYRACHEADRA2A
SCHEMBL8342327 0.77 HTR2A (0.50) SLC6A4HTR2AKCNH2ADRA2AADRA1A
SCHEMBL2817075 0.76 HTR2A (0.49) SLC6A4HTR2AKCNH2TDP1ADRA2A
SCHEMBL10311194 0.75 CRHR1 (0.48) SLC6A4HTR2AKCNH2BCHETYR
SCHEMBL474013 0.74 PDE2A (0.51) SLC6A4HTR2AKCNH2TDP1ADRA2A

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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