SCHEMBL31334136

SCHEMBL31334136

COC(=O)[C@H]1CC[C@H](Nc2ncc(F)c(-c3cccc(-n4cc(C)ccc4=O)c3)n2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 8/20 0.39
ADORA2A P29274 4/20 0.39
CDK2 P24941 2/20 0.38
CCNB2 O95067 1/20 0.38
CCNE2 O96020 1/20 0.38
CDK1 P06493 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
ADORA1 P30542 3/20 0.38
ROCK2 O75116 2/20 0.37
ROCK1 Q13464 2/20 0.37
CCNA2 P20248 1/20 0.37
MAPK3 P27361 1/20 0.37
CDK4 P11802 2/20 0.37
CCND1 P24385 2/20 0.37
CCND3 P30281 2/20 0.37
CDK6 Q00534 2/20 0.37

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
SCHEMBL31334356 1.00 MAPK1 (0.39) MAPK1ADORA2ACDK2CCNB2CCNE2
SCHEMBL31335020 0.92 IRAK4 (0.40) MAPK1ADORA2ACDK2CCNB2CCNE2
SCHEMBL31334253 0.92 IRAK4 (0.40) MAPK1ADORA2ACDK2CCNB2CCNE2
SCHEMBL31333244 0.91 MAPK6 (0.41) MAPK1CDK2CCNB2CCNE2CDK1
SCHEMBL31334023 0.90 MAPK1 (0.39) MAPK1ADORA2ACDK2CCNB2CCNE2
SCHEMBL31334507 0.89 SYK (0.43) MAPK1ADORA2ACDK2CCNB2CCNE2
SCHEMBL31334263 0.89 SYK (0.43) MAPK1ADORA2ACDK2CCNB2CCNE2
SCHEMBL31333692 0.89 MAPK8 (0.40) MAPK1CDK2CCNB2CCNE2CDK1
SCHEMBL31334668 0.88 MAPK8 (0.45) MAPK1ADORA2ACDK2CCNB2CCNE2
SCHEMBL31333306 0.86 MAPK1 (0.45) MAPK1CDK2CCNB2CCNE2CDK1

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