SCHEMBL31334884

SCHEMBL31334884

O=C(O)C1CCCC(Nc2ncc(F)c(-c3cccc(C4(O)COC4)c3)n2)C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 4/20 0.43
ADORA1 P30542 3/20 0.39
CTSA P10619 3/20 0.38
MAPK1 P28482 6/20 0.37
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
DYRK2 Q92630 1/20 0.35
BTK Q06187 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34
CDK7 P50613 2/20 0.34
MAPK8 P45983 1/20 0.34

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
SCHEMBL31334606 0.92 MAPK3 (0.40) MAPK3ADORA1CTSAMAPK1CCNA2
SCHEMBL31334409 0.91 IRAK1 (0.42) MAPK3ADORA1CTSAMAPK1CCNA2
SCHEMBL31334596 0.90 ADORA1 (0.41) MAPK3ADORA1CTSAMAPK1CCNA2
SCHEMBL31334123 0.85 MAPK3 (0.47) MAPK3ADORA1MAPK1CDK2ADORA2A
SCHEMBL31333196 0.84 MAPK3 (0.42) MAPK3ADORA1CTSAMAPK1CCNA2
SCHEMBL31334522 0.83 CTSA (0.41) MAPK3ADORA1CTSAMAPK1CCNA2
SCHEMBL31335048 0.82 MAPK3 (0.41) MAPK3ADORA1MAPK1CCNA2CDK2
SCHEMBL31334731 0.82 MAPK3 (0.41) MAPK3ADORA1MAPK1CCNA2CDK2
SCHEMBL31333561 0.82 MAPK3 (0.43) MAPK3ADORA1MAPK1CCNA2CDK2
SCHEMBL31333828 0.82 MAPK3 (0.43) MAPK3ADORA1MAPK1CCNA2CDK2

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