SCHEMBL25879156

SCHEMBL25879156

c1ccc(-c2ccc(-c3ccc(N(c4ccc5ccc6sc7ccccc7c6c5c4)c4ccccc4-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 1/20 0.34
▸ CDK4 P11802 4/20 0.31
▸ CCND1 P24385 4/20 0.31
▸ CCNB2 O95067 1/20 0.31
▸ CCNE2 O96020 1/20 0.31
▸ CDK1 P06493 1/20 0.31
▸ CCNB1 P14635 1/20 0.31
▸ CCNE1 P24864 1/20 0.31
▸ CDK2 P24941 1/20 0.31
▸ CCNB3 Q8WWL7 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
SCHEMBL25879161 1.00 F9 (0.34) F9CDK4CCND1CCNB2CCNE2
SCHEMBL23511999 0.95 F9 (0.33) F9CDK4CCND1CCNB2CCNE2
SCHEMBL25879162 0.95 CDK4 (0.35) F9CDK4CCND1CCNB2CCNE2
SCHEMBL25879014 0.95 CDK4 (0.35) F9CDK4CCND1CCNB2CCNE2
SCHEMBL25879158 0.95 CDK4 (0.35) F9CDK4CCND1CCNB2CCNE2
SCHEMBL25879225 0.95 S1PR5 (0.33) F9CDK4CCND1
SCHEMBL25879147 0.94 F9 (0.37) F9CDK4CCND1CCNB2CCNE2
SCHEMBL25879018 0.93 S1PR5 (0.36) F9
SCHEMBL25881826 0.93 KDM4E (0.32) F9
SCHEMBL25879239 0.92 CDK4 (0.32) F9CDK4CCND1

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 — — WO disclosed
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