SCHEMBL9921515

SCHEMBL9921515

CCCCCCc1cccc(C2(c3cccc(C)c3)c3cc(Br)ccc3-c3ccc(Br)cc32)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LPL P06858 3/20 0.39
LIPG Q9Y5X9 3/20 0.39
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C19 P33261 2/20 0.36
GPR3 P46089 1/20 0.36
PPARG P37231 2/20 0.35
PPARA Q07869 2/20 0.35
DHFR P00374 2/20 0.35
NPC1 O15118 1/20 0.34
GAA P10253 1/20 0.34
NFKB1 P19838 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL12544748 0.94 LPL (0.43) LPLLIPGCYP1A2CYP2D6CYP2C19
SCHEMBL20042463 0.88 LPL (0.33) LPLLIPGCYP1A2CYP2D6CYP2C19
SCHEMBL18480408 0.86 LPL (0.31) LPLLIPG
SCHEMBL20962170 0.84 NPC1 (0.36) CYP1A2GPR3NPC1GAANFKB1
SCHEMBL19074968 0.84 NPC1 (0.36) CYP1A2GPR3NPC1GAANFKB1
SCHEMBL16276519 0.84 LPL (0.38) LPLLIPGCYP1A2CYP2D6CYP2C19
SCHEMBL16419881 0.83 LPL (0.44) LPLLIPGCYP1A2CYP2D6CYP2C19
SCHEMBL19320314 0.82 NPC1 (0.39) CYP1A2CYP2D6CYP2C19GPR3NPC1
SCHEMBL15316155 0.82 MAPK1 (0.48) CYP1A2CYP2D6CYP2C19
SCHEMBL16675102 0.82 SPHK2 (0.30) LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3037398-B1 METHOD FOR MANUFACTURING CHEMICAL COMPOUND SUMITOMO CHEMICAL CO (JP) 2021-03-10 EP disclosed
US-9793486-B2 Polymer compound and light-emitting element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 US disclosed
US-9099666-B2 Organic light-emitting device CAMBRIDGE DISPLAY TECHNOLOGY, LTD. (GB) 2015-08-04 US disclosed
US-20140361274-A1 ORGANIC LIGHT-EMITTING DEVICE CAMBRIDGE DISPLAY TECHNOLOGY, LTD. (GB) 2014-12-11 US disclosed
WO-2012076836-A1 HOLE INJECTION LAYERS CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2012-06-14 WO disclosed