SCHEMBL24949655

SCHEMBL24949655

c1ccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2-c2ccc(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3cccc(-c4ccc5ccccc5c4)c3)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.32
AKT1 P31749 1/20 0.32
ALOX5 P09917 1/20 0.32
HSD17B1 P14061 2/20 0.31
HSD17B2 P37059 2/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2B6 P20813 1/20 0.30
CYP2C19 P33261 1/20 0.30
CYP11B1 P15538 1/20 0.30

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
SCHEMBL26488107 0.94 AKT1 (0.34) GPR84AKT1HSD17B1HSD17B2CYP1A2
SCHEMBL26487897 0.94 AKT1 (0.34) GPR84AKT1HSD17B1HSD17B2CYP1A2
SCHEMBL26488102 0.94 AKT1 (0.34) GPR84AKT1HSD17B1HSD17B2CYP1A2
SCHEMBL26488938 0.94 AKT1 (0.34) GPR84AKT1HSD17B1HSD17B2CYP1A2
SCHEMBL24948586 0.94 HSD17B1 (0.32) GPR84HSD17B1HSD17B2CYP1A2CYP3A4
SCHEMBL24948205 0.93 ALOX5 (0.33) GPR84ALOX5CYP11B1
SCHEMBL26487893 0.92 CA12 (0.34) AKT1HSD17B1HSD17B2CYP2C9CYP2C19
SCHEMBL24949662 0.92 AKT1 (0.34) GPR84AKT1HSD17B1HSD17B2CYP11B1
SCHEMBL24948169 0.91 MCL1 (0.34) GPR84ALOX5CYP11B1
SCHEMBL26487973 0.91 MCL1 (0.34) GPR84AKT1HSD17B1HSD17B2CYP2C9

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
WO-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed
WO-2023003403-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed