SCHEMBL31333828

SCHEMBL31333828

O=C(O)C1CCCC(Nc2ncc(F)c(-c3cccc(C4CCC4)c3)n2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 3/20 0.43
ADORA1 P30542 3/20 0.40
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CDK7 P50613 4/20 0.36
MAPK1 P28482 4/20 0.36
DYRK2 Q92630 1/20 0.36
CDK2 P24941 3/20 0.36
CCNE1 P24864 2/20 0.36
CCNT1 O60563 1/20 0.36
CCNK O75909 1/20 0.36
CDK9 P50750 1/20 0.36
CCNH P51946 1/20 0.36
MNAT1 P51948 1/20 0.36
CDK12 Q9NYV4 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
CCNB2 O95067 1/20 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
SCHEMBL31333561 1.00 MAPK3 (0.43) MAPK3ADORA1CSNK2A2CSNK2BCDK7
SCHEMBL31334731 0.93 MAPK3 (0.41) MAPK3ADORA1CSNK2A2CSNK2BCDK7
SCHEMBL31335048 0.93 MAPK3 (0.41) MAPK3ADORA1CSNK2A2CSNK2BCDK7
SCHEMBL31334771 0.91 SYK (0.42) MAPK3ADORA1CDK7MAPK1DYRK2
SCHEMBL31334123 0.90 MAPK3 (0.47) MAPK3ADORA1CSNK2A2CSNK2BCDK7
SCHEMBL31334463 0.89 BTK (0.48) MAPK3MAPK1DYRK2CDK2CCNT1
SCHEMBL31333233 0.87 NPC1 (0.43) MAPK3ADORA1CSNK2A2CSNK2BMAPK1
SCHEMBL31334502 0.84 MAPK3 (0.39) MAPK3ADORA1CDK7MAPK1CDK2
SCHEMBL31333857 0.84 SYK (0.43) MAPK3ADORA1CDK7MAPK1DYRK2
SCHEMBL31333944 0.82 ADORA1 (0.49) ADORA1CDK7CDK2CCNE1CCNT1

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