SCHEMBL29514845

SCHEMBL29514845

Cc1c(-c2nc(Nc3ccc(N4CCC(N(C)C)C4)cn3)ncc2F)sc2c1nc(C)n2C(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCND1 P24385 15/20 1.00
CDK6 Q00534 12/20 1.00
CDK4 P11802 15/20 0.75
CDK2 P24941 3/20 0.57
CCNA2 P20248 2/20 0.57
CDK9 P50750 2/20 0.57
CCND3 P30281 2/20 0.57
CCNT1 O60563 1/20 0.57
CDK5 Q00535 2/20 0.52
CCNK O75909 1/20 0.52
CDK7 P50613 1/20 0.52
CCNH P51946 1/20 0.52
CDK5R1 Q15078 1/20 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
SCHEMBL25237805 1.00 CCND1 (1.00) CCND1CDK6CDK4CDK2CCNA2
SCHEMBL29515005 0.86 CCND1 (1.00) CCND1CDK6CDK4CDK2CCNA2
SCHEMBL29514918 0.84 CCND1 (0.84) CCND1CDK6CDK4CDK2CCNA2
SCHEMBL24322347 0.84 CCND1 (0.84) CCND1CDK6CDK4CDK2CCNA2
SCHEMBL30926572 0.83 CDK6 (0.71) CCND1CDK6CDK4CDK2CCNA2
SCHEMBL17477154 0.83 CDK6 (0.71) CCND1CDK6CDK4CDK2CCNA2
SCHEMBL17477153 0.83 CDK6 (0.71) CCND1CDK6CDK4CDK2CCNA2
SCHEMBL17477176 0.83 CDK6 (0.71) CCND1CDK6CDK4CDK2CCNA2
SCHEMBL25235418 0.83 CCND1 (0.79) CCND1CDK6CDK4
SCHEMBL29515081 0.83 CCND1 (0.79) 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 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