SCHEMBL24947102

SCHEMBL24947102

c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4ccc5c(ccc6ccccc65)c4)cc3)c3cccc(-c4cccc(-n5c6ccccc6c6c7ccccc7ccc65)c4)c3)cc2)cc1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
HSD17B1 P14061 1/20 0.31
HSD17B2 P37059 1/20 0.31

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
SCHEMBL24948985 0.96 HSD17B1 (0.31) HSD17B1HSD17B2
SCHEMBL24949510 0.95
SCHEMBL24947101 0.94 CA12 (0.34)
SCHEMBL26149399 0.94 CDK4 (0.33) CDK4CCND1HSD17B1HSD17B2
SCHEMBL24948714 0.94 PDE10A (0.32)
SCHEMBL24949531 0.94 PDE10A (0.30)
SCHEMBL24949286 0.93 HSD17B1 (0.33) HSD17B1HSD17B2
SCHEMBL24949519 0.93
SCHEMBL24948155 0.93 KDM4E (0.31)
SCHEMBL24948198 0.93 KDM4E (0.31)

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