SCHEMBL29514980

SCHEMBL29514980

CCN1CC2(C1)CN(C(=O)c1ccc(Nc3ncc(F)c(-c4cc5nc(C)n(C(C)C)c5s4)n3)nc1)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCND1 P24385 17/20 1.00
CDK6 Q00534 12/20 1.00
CDK4 P11802 6/20 0.60
DYRK2 Q92630 3/20 0.52

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
SCHEMBL24322965 0.91 CCND1 (1.00) CCND1CDK6CDK4DYRK2
SCHEMBL25283091 0.83 CCND1 (1.00) CCND1CDK6CDK4
SCHEMBL29497098 0.83 CCND1 (1.00) CCND1CDK6CDK4
SCHEMBL29514983 0.79 CCND1 (0.73) CCND1CDK6CDK4DYRK2
SCHEMBL24322113 0.79 CCND1 (0.73) CCND1CDK6CDK4DYRK2
SCHEMBL24322147 0.79 CCND1 (0.81) CCND1CDK6CDK4
SCHEMBL19231733 0.77 CDK6 (0.62) CCND1CDK6CDK4DYRK2
SCHEMBL17489238 0.77 CDK6 (0.74) CCND1CDK6CDK4DYRK2
SCHEMBL25235412 0.77 CCND1 (0.87) CCND1CDK6CDK4DYRK2
SCHEMBL29514823 0.77 CCND1 (0.87) CCND1CDK6CDK4DYRK2

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