SCHEMBL25878775

SCHEMBL25878775

c1ccc(-c2cccc(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3ccc4ccc5sc6ccccc6c5c4c3)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 3/20 0.32
▸ CCND1 P24385 3/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ F9 P00740 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ MPI P34949 1/20 0.31
▸ KMT2A Q03164 1/20 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
▸ GPR84 Q9NQS5 1/20 0.31
▸ CA12 O43570 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
SCHEMBL25878774 0.95 GPR84 (0.32) CYP11B1KDM4EMEN1ALDH1A1MAPT
SCHEMBL25879389 0.94 HSD17B1 (0.34) CDK4CCND1CYP11B1F9KDM4E
SCHEMBL25879386 0.94 CDK4 (0.32) CDK4CCND1CYP11B1F9KDM4E
SCHEMBL25878778 0.94 CDK4 (0.32) CDK4CCND1CYP11B1KDM4EMEN1
SCHEMBL25881404 0.93 CDK4 (0.33) CDK4CCND1CYP11B1F9KDM4E
SCHEMBL25881401 0.92 CDK4 (0.32) CDK4CCND1CYP11B1F9KDM4E
SCHEMBL25879090 0.92 CA12 (0.39) CDK4CCND1F9CCNB2CCNE2
SCHEMBL25878926 0.91 CDK4 (0.37) CDK4CCND1F9MEN1MAPT
SCHEMBL25879097 0.91 CDK4 (0.37) CDK4CCND1F9MEN1MAPT
SCHEMBL25879012 0.91 CDK4 (0.37) CDK4CCND1F9MEN1MAPT

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
Send feedback