SCHEMBL13669712

SCHEMBL13669712

CCCCc1ccc(N(c2ccc(-c3ccc(N(c4ccc(CCCC)cc4)c4ccc(C(C)(C)CC)cc4)cc3)cc2)c2ccc(C(C)(C)CC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 6/20 0.44
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CNR2 P34972 1/20 0.40
▸ NISCH Q9Y2I1 1/20 0.40
▸ TSHR P16473 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ RARA P10276 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ MTOR P42345 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ KCNH2 Q12809 1/20 0.38
▸ HSD11B1 P28845 1/20 0.38
▸ PLK1 P53350 1/20 0.37

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
SCHEMBL13425901 0.94 CNR2 (0.43) RARBCA1CA2CNR2NISCH
SCHEMBL14942762 0.94 RARB (0.40) RARBCA1CA2CNR2NISCH
SCHEMBL14157859 0.92 RARB (0.38) RARBCA1CA2CNR2NISCH
SCHEMBL16351187 0.92 RARB (0.38) RARBCA1CA2CNR2NISCH
SCHEMBL14228174 0.89 CNR2 (0.46) RARBCA1CA2CNR2NISCH
SCHEMBL12645539 0.89 KCNH2 (0.41) CA1CA2HSD17B10NPC1RAB9A
SCHEMBL16542110 0.88 RARB (0.44) RARBCA1CA2NISCHTSHR
SCHEMBL7654592 0.87 KCNH2 (0.51) RARBCA1CA2NISCHTSHR
SCHEMBL3146748 0.87 KCNH2 (0.51) RARBCA1CA2NISCHTSHR
SCHEMBL16610361 0.85 UCHL3 (0.41) CA1CA2CNR2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8384066-B2 Polymer light-emitting device, polymer compound, composition, liquid composition, and conductive thin film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-26 — — US disclosed
WO-2009126918-A1 DOPED CONJUGATED POLYMERS, DEVICES, AND METHODS OF MAKING DEVICES PLEXTRONICS, INC. (US) 2009-10-15 — — WO disclosed
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