SCHEMBL29514969

SCHEMBL29514969

CCN1CC2(C1)CN(c1ccc(Nc3ncc(F)c(-c4cc5c(C6CCCC6)ccnc5s4)n3)nc1)C2

nearest known ligand 0.84

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCND1 P24385 19/20 0.84
CDK4 P11802 16/20 0.84
CDK6 Q00534 4/20 0.63
CDK1 P06493 1/20 0.56
CCNA2 P20248 1/20 0.56
CCND3 P30281 1/20 0.56

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
SCHEMBL29515053 0.91 CCND1 (1.00) CCND1CDK4CDK6CCNA2CCND3
SCHEMBL25280073 0.91 CCND1 (1.00) CCND1CDK4CDK6CCNA2CCND3
SCHEMBL29514946 0.88 CCND1 (0.84) CCND1CDK4CDK6CDK1CCNA2
SCHEMBL25694972 0.88 CCND1 (0.84) CCND1CDK4CDK6CDK1CCNA2
SCHEMBL29515048 0.86 CDK4 (1.00) CCND1CDK4CDK6CDK1CCNA2
SCHEMBL25289531 0.86 CDK4 (1.00) CCND1CDK4CDK6CDK1CCNA2
SCHEMBL25289103 0.84 CCND1 (1.00) CCND1CDK4CDK6CDK1CCNA2
SCHEMBL24322175 0.84 CDK4 (1.00) CCND1CDK4CDK6CDK1CCNA2
SCHEMBL29515120 0.84 CCND1 (1.00) CCND1CDK4CDK6CDK1CCNA2
SCHEMBL29514878 0.84 CDK4 (1.00) CCND1CDK4CDK6CDK1CCNA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4214213-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS Prelude Therapeutics, Incorporated (US) 2023-07-26 EP claimed
WO-2022061273-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS, INCORPORATED (US) 2022-03-24 WO claimed
EP-4214213-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS Prelude Therapeutics, Incorporated (US) 2023-07-26 EP disclosed
WO-2022061273-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS, INCORPORATED (US) 2022-03-24 WO disclosed