SCHEMBL24657452

SCHEMBL24657452

c1ccc(-c2cccc(N(c3ccc(-c4ccc5c(ccc6ccc7ccccc7c65)c4)cc3)c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 2/20 0.39
HSD17B2 P37059 2/20 0.39
CYP1A2 P05177 3/20 0.37
ERBB2 P04626 1/20 0.37
FYN P06241 1/20 0.37
MAOA P21397 1/20 0.37
ACHE P22303 1/20 0.37
AHR P35869 1/20 0.37
CDK4 P11802 3/20 0.36
CCND1 P24385 3/20 0.36
CYP11B1 P15538 1/20 0.36
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
HPGD P15428 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 2/20 0.35
MPI P34949 1/20 0.35
GPR84 Q9NQS5 2/20 0.34
CA12 O43570 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
SCHEMBL24656835 0.98 CYP1A2 (0.37) HSD17B1HSD17B2CYP1A2ERBB2FYN
SCHEMBL24655351 0.95 CDK4 (0.36) HSD17B1HSD17B2CYP1A2ERBB2FYN
SCHEMBL26055102 0.95 HSD17B1 (0.43) HSD17B1HSD17B2CYP1A2ERBB2FYN
SCHEMBL26062360 0.95 HSD17B1 (0.43) HSD17B1HSD17B2CYP1A2ERBB2FYN
SCHEMBL22670380 0.95 HSD17B1 (0.43) HSD17B1HSD17B2CYP1A2ERBB2FYN
SCHEMBL24657446 0.95 HPRT1 (0.38) HSD17B1HSD17B2CYP1A2ERBB2FYN
SCHEMBL24656404 0.94 ALDH1A1 (0.38) HSD17B1HSD17B2CYP1A2ERBB2FYN
SCHEMBL26062357 0.94 HSD17B1 (0.43) HSD17B1HSD17B2CYP1A2ERBB2FYN
SCHEMBL24657184 0.93 HSD17B1 (0.35) HSD17B1HSD17B2CYP1A2ERBB2FYN
SCHEMBL24655346 0.93 HSD17B1 (0.41) HSD17B1HSD17B2CYP1A2ERBB2FYN

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
EP-4243100-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-09-13 EP disclosed
WO-2022177374-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-08-25 WO disclosed