SCHEMBL13354844

SCHEMBL13354844

CCCCc1ccc(N(c2ccc(C(C)(C)CCC)cc2)c2ccc(C(C)(C)CCCC)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CNR2 P34972 3/20 0.40
▸ KCNH2 Q12809 1/20 0.38
▸ PLK1 P53350 1/20 0.37
▸ LPL P06858 4/20 0.37
▸ LIPG Q9Y5X9 4/20 0.37
▸ HPGD P15428 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ MGLL Q99685 1/20 0.36
▸ TNNC1 P63316 4/20 0.36
▸ SGPL1 O95470 1/20 0.36
▸ S1PR4 O95977 1/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ GPR183 P32249 1/20 0.36

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
SCHEMBL18531364 1.00 CA2 (0.41) CA2CA1CNR2KCNH2PLK1
SCHEMBL13425909 0.97 CA2 (0.43) CA2CA1CNR2KCNH2PLK1
SCHEMBL14228174 0.92 CNR2 (0.46) CA2CA1CNR2KCNH2PLK1
SCHEMBL13434787 0.92 KCNH2 (0.47) CA2CA1CNR2KCNH2PLK1
SCHEMBL14390805 0.92 CNR2 (0.48) CA2CA1CNR2LPLLIPG
SCHEMBL14419136 0.92 CNR2 (0.48) CA2CA1CNR2LPLLIPG
SCHEMBL13425901 0.88 CNR2 (0.43) CA2CA1CNR2KCNH2PLK1
SCHEMBL18533016 0.87 CNR2 (0.48) CA2CA1CNR2ALDH1A1HSD17B10
SCHEMBL14466891 0.87 CNR2 (0.42) CA2CA1CNR2KCNH2PLK1
SCHEMBL13294533 0.84 CNR2 (0.42) CNR2ALDH1A1

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-8298685-B2 Block copolymer and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-30 — — US disclosed
US-20100108993-A1 BLOCK COPOLYMER AND POLYMER LIGHT-EMITTING DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-06 — — US disclosed
US-20100090206-A1 POLYMER LIGHT-EMITTING DEVICE, POLYMER COMPOUND, COMPOSITION, LIQUID COMPOSITION, AND CONDUCTIVE THIN FILM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-15 — — US disclosed
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