SCHEMBL12593172

SCHEMBL12593172

CCCCCc1cc2c(cc1C)sc1cc(C)c(CCCCC)cc12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 1/20 0.37
▸ ALOX5 P09917 5/20 0.36
▸ TYR P14679 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ TLR8 Q9NR97 5/20 0.33
▸ PTGS2 P35354 5/20 0.33
▸ LIPG Q9Y5X9 1/20 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
SCHEMBL13400948 0.98 GPR35 (0.39) GPR35ALOX5TYRCYP3A4MEN1
SCHEMBL12593171 0.98 GPR35 (0.39) GPR35ALOX5TYRCYP3A4MEN1
SCHEMBL12593225 0.89 GPR35 (0.35) GPR35ALOX5TYRCYP3A4MEN1
SCHEMBL12593227 0.88 GPR35 (0.38) GPR35ALOX5TYRCYP3A4MEN1
SCHEMBL30807990 0.79 GPR35 (0.38) GPR35ALOX5TYRCYP3A4MEN1
SCHEMBL16978719 0.78 GPR35 (0.31) GPR35TYR
SCHEMBL20816041 0.78 ALOX5 (0.48) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL15497410 0.75 GPR35 (0.38) GPR35ALOX5TYRCYP3A4MEN1
SCHEMBL3165636 0.75 GPR3 (0.44) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL25444275 0.75 SKP2 (0.40) CYP3A4MEN1TP53MAPTALOX15

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
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
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