SCHEMBL4789204

SCHEMBL4789204

CCCCCCc1csc(-c2sccc2CCCCCCS)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 5/20 0.33
▸ TP53 P04637 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TYR P14679 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ PTGS2 P35354 3/20 0.33
▸ ESR1 P03372 2/20 0.33
▸ ADRA2A P08913 2/20 0.33
▸ ADORA3 P0DMS8 2/20 0.33
▸ TACR2 P21452 2/20 0.33
▸ SLC6A2 P23975 2/20 0.33
▸ SLC6A4 P31645 2/20 0.33
▸ SLC6A3 Q01959 2/20 0.33

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
SCHEMBL13197214 0.93 PTGS2 (0.37) TP53CYP3A4MEN1ALOX5MAPT
SCHEMBL14666230 0.93 PTGS2 (0.37) TP53CYP3A4MEN1ALOX5MAPT
SCHEMBL5572576 0.93 PTGS2 (0.37) TP53CYP3A4MEN1ALOX5MAPT
SCHEMBL869748 0.87 THRA (0.37) TP53CYP3A4MEN1ALOX5MAPT
SCHEMBL14667889 0.86 GPR35 (0.33) TP53CYP3A4MEN1ALOX5MAPT
SCHEMBL12610457 0.86 GPR35 (0.33) TP53CYP3A4MEN1ALOX5MAPT
SCHEMBL15478097 0.86 GPR35 (0.33) TP53CYP3A4MEN1ALOX5MAPT
SCHEMBL86120 0.81 GPR35 (0.31) GPR35
SCHEMBL13839137 0.80 GPR35 (0.31) GPR35
SCHEMBL15804009 0.79 ALOX5 (0.30) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008144758-A2 ORGANIC ELECTRODES AND ELECTRONIC DEVICES PLEXTRONICS, INC. (US) 2008-11-27 — — WO claimed
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