SCHEMBL31333693

SCHEMBL31333693

N[C@H]1CC[C@H](Nc2ncc(F)c(-c3ccnc(N4CCOCC4=O)c3)n2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNK O75909 1/20 0.41
CSNK1A1 P48729 1/20 0.41
CDK7 P50613 1/20 0.41
CDK9 P50750 1/20 0.41
CDK13 Q14004 1/20 0.41
CDK12 Q9NYV4 1/20 0.41
MAPK1 P28482 8/20 0.41
CDK2 P24941 2/20 0.41
CCNA2 P20248 1/20 0.41
MAPK3 P27361 1/20 0.41
RAF1 P04049 2/20 0.40
BRAF P15056 2/20 0.40
HRH4 Q9H3N8 2/20 0.40
MAPK8 P45983 1/20 0.39
MAPK10 P53779 1/20 0.39
CSNK1D P48730 1/20 0.39
CCNB2 O95067 1/20 0.39
CCNE2 O96020 1/20 0.39
CDK1 P06493 1/20 0.39
CCNB1 P14635 1/20 0.39

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
SCHEMBL31333554 0.90 RAF1 (0.42) MAPK1CDK2CCNA2MAPK3RAF1
SCHEMBL31333463 0.89 RAF1 (0.42) MAPK1CDK2CCNA2MAPK3RAF1
SCHEMBL31334337 0.89 CDK7 (0.42) CCNKCSNK1A1CDK7CDK9CDK13
SCHEMBL31333818 0.88 RAF1 (0.43) MAPK1CDK2CCNA2MAPK3RAF1
SCHEMBL31334548 0.88 CDK7 (0.42) CCNKCSNK1A1CDK7CDK9CDK13
SCHEMBL31333653 0.87 CDK7 (0.42) CCNKCSNK1A1CDK7CDK9CDK13
SCHEMBL31334480 0.86 MAPK1 (0.45) CSNK1A1MAPK1CDK2CCNA2MAPK3
SCHEMBL31333681 0.86 MAP4K1 (0.46) CCNKCSNK1A1CDK7CDK9CDK13
SCHEMBL31333754 0.86 CDK9 (0.42) CCNKCSNK1A1CDK7CDK9CDK13
SCHEMBL31333582 0.85 CDK7 (0.41) CCNKCSNK1A1CDK7CDK9CDK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709720-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2026-03-18 EP disclosed
WO-2024233846-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES, INC. (US) 2024-11-14 WO disclosed