SCHEMBL31334023

SCHEMBL31334023

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 6/20 0.39
ADORA2A P29274 4/20 0.37
CBL P22681 1/20 0.37
CBLB Q13191 1/20 0.37
ADORA1 P30542 3/20 0.37
CDK2 P24941 5/20 0.37
CDK1 P06493 2/20 0.37
CCNB1 P14635 2/20 0.37
CCNE1 P24864 2/20 0.37
CCNB2 O95067 1/20 0.37
CCNE2 O96020 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
CCNB3 Q8WWL7 1/20 0.37
MCHR1 Q99705 1/20 0.36
CCNA2 P20248 3/20 0.36
MAPK3 P27361 1/20 0.36
CDK4 P11802 2/20 0.36
CCND1 P24385 2/20 0.36
CCND3 P30281 2/20 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
SCHEMBL31333236 0.91 SYK (0.38) MAPK1ADORA1CDK2CDK1CCNB1
SCHEMBL31334506 0.91 MAPK3 (0.40) MAPK1CDK2CDK1CCNB1CCNE1
SCHEMBL31334356 0.90 MAPK1 (0.39) MAPK1ADORA2AADORA1CDK2CDK1
SCHEMBL31334136 0.90 MAPK1 (0.39) MAPK1ADORA2AADORA1CDK2CDK1
SCHEMBL31334568 0.89 KDM1A (0.39) MAPK1CBLCBLBCDK2CDK1
SCHEMBL31334263 0.87 SYK (0.43) MAPK1ADORA2AADORA1CDK2CDK1
SCHEMBL31334507 0.87 SYK (0.43) MAPK1ADORA2AADORA1CDK2CDK1
SCHEMBL31334697 0.85 MAPK1 (0.41) MAPK1CBLCBLBCDK2CCNA2
SCHEMBL31333858 0.85 MAPK3 (0.41) MAPK1CDK2CCNA2MAPK3CCNA1
SCHEMBL31333877 0.84 CDK2 (0.40) MAPK1CDK2CCNE1CCNA2MAPK3

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