SCHEMBL24323006

SCHEMBL24323006

Cc1c(-c2nc(Nc3ccc(C4CCC5CN(C)C(=O)CN54)cn3)ncc2F)sc2c1nc(C)n2C(C)C

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCND1 P24385 20/20 0.69
CDK6 Q00534 11/20 0.69
CDK4 P11802 11/20 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
SCHEMBL25237816 1.00 CCND1 (0.69) CCND1CDK6CDK4
SCHEMBL24322101 0.82 CCND1 (1.00) CCND1CDK6CDK4
SCHEMBL29514993 0.78 CCND1 (0.77) CCND1CDK6CDK4
SCHEMBL24323608 0.78 CCND1 (0.77) CCND1CDK6CDK4
SCHEMBL25283162 0.77 CCND1 (0.78) CCND1CDK6CDK4
SCHEMBL29515005 0.74 CCND1 (1.00) CCND1CDK6CDK4
SCHEMBL29514845 0.74 CCND1 (1.00) CCND1CDK6CDK4
SCHEMBL25237805 0.74 CCND1 (1.00) CCND1CDK6CDK4
SCHEMBL25234880 0.73 CCND1 (1.00) CCND1CDK6CDK4
SCHEMBL29514816 0.73 CCND1 (1.00) CCND1CDK6CDK4

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-2022061273-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS, INCORPORATED (US) 2022-03-24 WO disclosed