SCHEMBL29514864

SCHEMBL29514864

CCN1CC2(C1)CN(c1ccc(Nc3ncc(F)c(-c4cc5ncn(C(C)C)c5s4)n3)nc1)C2

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCND1 P24385 18/20 0.70
CDK6 Q00534 10/20 0.70
CDK4 P11802 11/20 0.62
CDK1 P06493 1/20 0.51
CCNA2 P20248 1/20 0.51
CCND3 P30281 1/20 0.51

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
SCHEMBL24323643 1.00 CCND1 (0.70) CCND1CDK6CDK4CDK1CCNA2
SCHEMBL24323642 0.91 CCND1 (0.63) CCND1CDK6CDK4CDK1CCNA2
SCHEMBL29514916 0.82 CCND1 (1.00) CCND1CDK6CDK4
SCHEMBL29514867 0.81 CCND1 (0.67) CCND1CDK6CDK4CDK1CCNA2
SCHEMBL25278596 0.81 CCND1 (0.67) CCND1CDK6CDK4CDK1CCNA2
SCHEMBL29514854 0.78 CCND1 (0.88) CCND1CDK6CDK4CDK1CCNA2
SCHEMBL29514946 0.78 CCND1 (0.84) CCND1CDK6CDK4CDK1CCNA2
SCHEMBL25694972 0.78 CCND1 (0.84) CCND1CDK6CDK4CDK1CCNA2
SCHEMBL25237814 0.77 CCND1 (1.00) CCND1CDK6CDK4CDK1CCNA2
SCHEMBL29514858 0.77 CCND1 (1.00) CCND1CDK6CDK4CDK1CCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116583283-A CDK inhibitors and their use as pharmaceuticals 普莱鲁德疗法有限公司 2023-08-11 CN claimed
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