SCHEMBL12593227

SCHEMBL12593227

CCCCCCCCc1cc2sc3cc(C)c(C)cc3c2cc1CCCCCCCC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 2/20 0.38
▸ ALOX5 P09917 4/20 0.37
▸ TYR P14679 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ LIPG Q9Y5X9 1/20 0.34
▸ PTGS2 P35354 5/20 0.33
▸ TLR8 Q9NR97 3/20 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
SCHEMBL12593225 0.98 GPR35 (0.35) GPR35ALOX5TYRMEN1TP53
SCHEMBL13400948 0.90 GPR35 (0.39) GPR35ALOX5TYRMEN1TP53
SCHEMBL12593171 0.90 GPR35 (0.39) GPR35ALOX5TYRMEN1TP53
SCHEMBL12593172 0.88 GPR35 (0.37) GPR35ALOX5TYRMEN1TP53
SCHEMBL3165636 0.81 GPR3 (0.44) ALOX5TYRMEN1TP53CYP3A4
SCHEMBL30807990 0.78 GPR35 (0.38) GPR35ALOX5TYRMEN1TP53
SCHEMBL15497410 0.78 GPR35 (0.38) GPR35ALOX5TYRMEN1TP53
SCHEMBL13475177 0.76 TLR8 (0.36) GPR35ALOX5TYRMEN1TP53
SCHEMBL12396855 0.74 ESR1 (0.41) MEN1CYP3A4MAPTKMT2ATLR8
SCHEMBL12018766 0.74 ESR1 (0.41) MEN1CYP3A4MAPTKMT2ATLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110121278-A1 SOLUTION COMPOSITION AND POLYMER LIGHT-EMITTING DEVICE SUMITOMO CHEMICAL CO., LTD. (JP) 2011-05-26 — — US disclosed
US-7910025-B2 Solution composition and polymer light-emitting device SUMITOMO CHEMICAL CO., LTD. (JP) 2011-03-22 — — US disclosed
US-20080061673-A1 Solution Composition And Polymer Light-Emitting Device SUMITOMO CHEMICAL CO., LTD. (JP) 2008-03-13 — — US disclosed
US-7208567-B2 Polymer compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-24 — — US disclosed
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