SCHEMBL31334085

SCHEMBL31334085

O=C(C1CCC(Nc2ncc(F)c(-c3cccc(-c4ccc[nH]c4=O)c3)n2)CC1)N1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 2/20 0.49
JUN P05412 1/20 0.49
MAPK1 P28482 8/20 0.42
DYRK2 Q92630 5/20 0.42
CCNT1 O60563 3/20 0.42
CCNK O75909 3/20 0.42
CCNE1 P24864 3/20 0.42
CDK2 P24941 3/20 0.42
CDK9 P50750 3/20 0.42
CDK12 Q9NYV4 3/20 0.42
MAPK8 P45983 1/20 0.42
MAPK9 P45984 1/20 0.42
ADORA1 P30542 2/20 0.39
CDK7 P50613 1/20 0.38
CCNH P51946 1/20 0.38
MNAT1 P51948 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA2B P29275 1/20 0.38

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
SCHEMBL31333686 0.88 ADORA1 (0.44) MAPK10JUNMAPK1CCNT1CCNK
SCHEMBL31334804 0.88 CDK2 (0.43) MAPK1CCNT1CCNKCCNE1CDK2
SCHEMBL31334122 0.88 CDK2 (0.43) MAPK1CCNT1CCNKCCNE1CDK2
SCHEMBL31334963 0.87 CDK9 (0.43) MAPK10JUNMAPK1CCNT1CCNK
SCHEMBL31334899 0.86 CCNT1 (0.43) MAPK10JUNMAPK1CCNT1CCNK
SCHEMBL31334562 0.85 CDK2 (0.42) MAPK10JUNMAPK1CCNT1CCNK
SCHEMBL31335133 0.84 CCNE1 (0.43) MAPK10JUNMAPK1CCNT1CCNK
SCHEMBL31333403 0.84 MAPK1 (0.46) MAPK10JUNMAPK1CCNT1CCNK
SCHEMBL31333245 0.84 CDK9 (0.46) MAPK10MAPK1CCNT1CCNKCCNE1
SCHEMBL31333676 0.83 CCNE1 (0.49) MAPK1CCNT1CCNKCCNE1CDK2

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