SCHEMBL31334320

SCHEMBL31334320

COC(=O)[C@H]1CC[C@H](Nc2ncc(F)c(-c3ccnc(N4CCCCC4=O)c3)n2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.39
CDK2 P24941 6/20 0.38
CDK1 P06493 5/20 0.38
CCNB2 O95067 1/20 0.38
CCNE2 O96020 1/20 0.38
CCNB1 P14635 1/20 0.38
CCNE1 P24864 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
CCNB3 Q8WWL7 1/20 0.38
MAPK10 P53779 2/20 0.37
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
DYRK2 Q92630 3/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
CCNA2 P20248 1/20 0.36
MAPK3 P27361 1/20 0.36
CDK4 P11802 5/20 0.36
CCND1 P24385 5/20 0.36

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
SCHEMBL31333345 0.98 MAPK1 (0.40) MAPK1CDK2CDK1CCNB2CCNE2
SCHEMBL31333241 0.91 ADORA2A (0.40) MAPK1CDK2CDK1CCNB2CCNE2
SCHEMBL31333826 0.90 MAPK1 (0.39) MAPK1CDK2CDK1CCNB2CCNE2
SCHEMBL31333274 0.89 MAPK8 (0.43) MAPK1CDK2CDK1CCNB2CCNE2
SCHEMBL31334271 0.88 ADORA2A (0.40) MAPK1CDK2CDK1CCNB2CCNE2
SCHEMBL31333975 0.88 PRKD1 (0.40) MAPK1CDK2CDK1CCNB2CCNE2
SCHEMBL31333326 0.87 MAPK1 (0.41) MAPK1CDK2CDK1CCNB2CCNE2
SCHEMBL31333680 0.87 SYK (0.46) MAPK1CDK2CDK1CCNB2CCNE2
SCHEMBL31333653 0.87 CDK7 (0.42) MAPK1CDK2CDK1CCNB2CCNE2
SCHEMBL31334761 0.86 MAPK8 (0.43) MAPK1CDK2CDK1CCNB2CCNE2

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