SCHEMBL31333396

SCHEMBL31333396

O=C(C1CCC(Nc2ncc(F)c(-c3cccc(N4CCCOC4=O)c3)n2)CC1)N1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDK6 Q00534 5/20 0.42
CCND1 P24385 3/20 0.42
DYRK2 Q92630 10/20 0.41
MAPK1 P28482 4/20 0.40
JUN P05412 1/20 0.40
MAPK10 P53779 1/20 0.40
PIM1 P11309 1/20 0.38
CDK4 P11802 1/20 0.38
CCND3 P30281 1/20 0.38
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
MAPK3 P27361 1/20 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
SCHEMBL31335093 0.93 MAPK10 (0.44) CDK6CCND1DYRK2MAPK1JUN
SCHEMBL31334261 0.90 CDK6 (0.40) CDK6CCND1DYRK2MAPK1CDK4
SCHEMBL31333597 0.89 MAPK1 (0.41) CCND1DYRK2MAPK1JUNMAPK10
SCHEMBL31334417 0.88 MAPK1 (0.41) CCND1DYRK2MAPK1JUNMAPK10
SCHEMBL31334975 0.88 MAPK1 (0.41) CCND1DYRK2MAPK1JUNMAPK10
SCHEMBL31334432 0.87 MAPK1 (0.41) CCND1DYRK2MAPK1JUNMAPK10
SCHEMBL31334717 0.87 ADORA1 (0.43) CDK6MAPK1MAPK10CDK4CCNA2
SCHEMBL31334262 0.85 MAPK1 (0.41) CCND1DYRK2MAPK1MAPK10CDK4
SCHEMBL31334163 0.85 MAPK1 (0.44) CDK6CCND1DYRK2MAPK1CDK4
SCHEMBL31334897 0.85 CDK6 (0.42) CDK6CCND1DYRK2MAPK1CDK4

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