SCHEMBL29514849

SCHEMBL29514849

Cc1c(-c2nc(Nc3ccc(N4CCC(F)(F)C4)cn3)ncc2F)sc2c1nc(C)n2C1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCND1 P24385 20/20 1.00
CDK4 P11802 17/20 1.00
CDK6 Q00534 10/20 0.76
CCNA2 P20248 5/20 0.49
CDK2 P24941 5/20 0.49
CCND3 P30281 5/20 0.49
CCNT1 O60563 3/20 0.49
CDK7 P50613 3/20 0.49
CDK9 P50750 3/20 0.49
CCNH P51946 3/20 0.49
CDK1 P06493 3/20 0.49
CCNB1 P14635 3/20 0.49

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
SCHEMBL25243806 1.00 CCND1 (1.00) CCND1CDK4CDK6CCNA2CDK2
SCHEMBL29515067 0.89 CDK4 (0.84) CCND1CDK4CDK6CCNA2CDK2
SCHEMBL29514958 0.87 CCND1 (1.00) CCND1CDK4CDK6CCNA2CDK2
SCHEMBL24322323 0.87 CCND1 (1.00) CCND1CDK4CDK6CCNA2CDK2
SCHEMBL29514921 0.85 CCND1 (0.97) CCND1CDK4CDK6CCNA2CDK2
SCHEMBL25242826 0.85 CCND1 (0.97) CCND1CDK4CDK6CCNA2CDK2
SCHEMBL25285170 0.81 CCND1 (0.68) CCND1CDK4CDK6CCNA2CDK2
SCHEMBL29515058 0.81 CCND1 (0.68) CCND1CDK4CDK6CCNA2CDK2
SCHEMBL25289547 0.79 CCND1 (0.79) CCND1CDK4CDK6CCNA2CDK2
SCHEMBL25285207 0.79 CCND1 (1.00) CCND1CDK4CDK6CCNA2CDK2

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 6 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
CN-116583283-A CDK inhibitors and their use as pharmaceuticals 普莱鲁德疗法有限公司 2023-08-11 CN disclosed
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