SCHEMBL29226288

SCHEMBL29226288

CCOc1ccc(N2CCN(C)CC2)cc1Nc1ncc(F)c(-c2ccc3c(c2)C(=O)NC32CC2)n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TNK2 Q07912 8/20 0.47
▸ CDK6 Q00534 10/20 0.46
▸ CCND1 P24385 9/20 0.46
▸ CDK4 P11802 7/20 0.46
▸ CCNA2 P20248 7/20 0.46
▸ CDK2 P24941 7/20 0.46
▸ CCND3 P30281 7/20 0.46
▸ CCNE2 O96020 4/20 0.46
▸ CDK1 P06493 4/20 0.46
▸ CCNT1 O60563 3/20 0.43
▸ CDK9 P50750 3/20 0.43
▸ CDK7 P50613 2/20 0.43
▸ CCNH P51946 2/20 0.43
▸ MNAT1 P51948 2/20 0.43
▸ PIM1 P11309 1/20 0.43
▸ EGFR P00533 2/20 0.43

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
SCHEMBL29226364 0.93 CDK6 (0.44) TNK2CDK6CCND1CDK4CCNA2
SCHEMBL29226349 0.93 TNK2 (0.51) TNK2CCNA2CDK2CDK1EGFR
SCHEMBL29227026 0.91 EGFR (0.46) TNK2CDK6CCND1CDK4CCNA2
SCHEMBL29227028 0.91 ALK (0.46) TNK2CDK6CCND1CDK4CCNA2
SCHEMBL29226263 0.91 PLK1 (0.51) CDK6CCND1CDK4CCNA2CDK2
SCHEMBL29226305 0.89 CDK6 (0.49) TNK2CDK6CCND1CDK4CCNA2
SCHEMBL29246590 0.88 CCND1 (0.46) TNK2CDK6CCND1CDK4CCNA2
SCHEMBL30978399 0.88 CCND1 (0.44) TNK2CDK6CCND1CDK4CCNA2
SCHEMBL29246530 0.87 CCND1 (0.44) TNK2CDK6CCND1CDK4CCNA2
SCHEMBL29246619 0.87 CDK6 (0.48) TNK2CDK6CCND1CDK4CCNA2

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
CN-117658987-A Compounds as PLK1 inhibitors, and preparation method and application thereof 上海深势唯思科技有限责任公司 2024-03-08 — — CN disclosed
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