SCHEMBL27360239

SCHEMBL27360239

Cc1cc(N2CCNCC2)ccc1Nc1ncc2cc(Cl)c(=O)n(C3CCCC3)c2n1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 20/20 0.68
CCND1 P24385 20/20 0.68
CCNA2 P20248 12/20 0.68
CDK2 P24941 12/20 0.68
FGFR1 P11362 10/20 0.68
FGFR2 P21802 10/20 0.68
FGFR4 P22455 10/20 0.68
FGFR3 P22607 10/20 0.68
CCND2 P30279 8/20 0.67
CCND3 P30281 8/20 0.67
CCNA1 P78396 4/20 0.67
CCNE2 O96020 1/20 0.59
CCNE1 P24864 1/20 0.59

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
SCHEMBL27360176 0.89 CDK4 (0.55) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL29991330 0.89 CDK4 (0.55) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL25122954 0.89 CDK4 (0.55) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL27360237 0.88 TTK (0.54) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL27360012 0.86 CDK4 (0.52) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL27358291 0.84 CCND1 (0.51) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL27360177 0.83 TTK (0.49) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL30883462 0.83 CCND1 (0.51) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL27225511 0.83 CCND1 (0.51) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL27358626 0.82 CCND1 (0.54) CDK4CCND1CCNA2CDK2FGFR1

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-2024039903-A2 CDK2 INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2024-02-22 WO disclosed