SCHEMBL16158356

SCHEMBL16158356

c1ccc(-c2cccc(N(c3ccc(-c4ccc(-c5ccc(N(c6cccc(-c7ccccc7)c6)c6cc7ccccc7c7ccccc67)cc5)cc4)cc3)c3cc4ccccc4c4ccccc34)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.35
HSD17B1 P14061 2/20 0.34
HSD17B2 P37059 2/20 0.34
CYP11B1 P15538 1/20 0.33
TRPM4 Q8TD43 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
MPI P34949 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.33
HIF1A Q16665 1/20 0.32
CYP1B1 Q16678 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL16158235 1.00 GPR84 (0.35) GPR84HSD17B1HSD17B2CYP11B1TRPM4
SCHEMBL22670259 1.00 GPR84 (0.35) GPR84HSD17B1HSD17B2CYP11B1TRPM4
SCHEMBL16158242 1.00 GPR84 (0.35) GPR84HSD17B1HSD17B2CYP11B1TRPM4
SCHEMBL16158388 1.00 GPR84 (0.35) GPR84HSD17B1HSD17B2CYP11B1TRPM4
SCHEMBL23626449 0.98 GPR84 (0.34) GPR84HSD17B1HSD17B2CYP11B1TRPM4
SCHEMBL22671275 0.98 GPR84 (0.34) GPR84HSD17B1HSD17B2CYP11B1TRPM4
SCHEMBL16158249 0.98 GPR84 (0.35) GPR84HSD17B1HSD17B2CYP11B1TRPM4
SCHEMBL16158265 0.98 GPR84 (0.35) GPR84HSD17B1HSD17B2CYP11B1TRPM4
SCHEMBL22670962 0.97 TRPM4 (0.35) GPR84HSD17B1HSD17B2CYP11B1TRPM4
SCHEMBL16158342 0.97 GPR84 (0.36) GPR84HSD17B1HSD17B2CYP11B1TRPM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014163228-A1 NOVEL ORGANIC ELECTROLUMINESCENT ELEMENT COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME (주)피엔에이치테크 (KR) 2014-10-09 WO disclosed