SCHEMBL31333797

SCHEMBL31333797

O=C(N[C@H]1CC[C@H](Nc2ncc(Cl)c(-c3cccc(-c4ccc(F)cc4)c3)n2)CC1)C1CCN(C2CCNCC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 15/20 0.44
PKM P14618 1/20 0.43
ACKR3 P25106 1/20 0.38
CCNT1 O60563 1/20 0.38
CCNK O75909 1/20 0.38
CCNE1 P24864 1/20 0.38
CDK2 P24941 1/20 0.38
CDK9 P50750 1/20 0.38
CDK12 Q9NYV4 1/20 0.38
F10 P00742 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
SCHEMBL31333534 0.93 MAPK1 (0.45) MAPK1CCNT1CCNKCCNE1CDK2
SCHEMBL31334904 0.90 PKM (0.47) MAPK1PKM
SCHEMBL31334277 0.88 MAPK1 (0.43) MAPK1PKMCCNT1
SCHEMBL31333318 0.87 F10 (0.42) MAPK1PKMF10
SCHEMBL31334587 0.84 ROCK1 (0.41) MAPK1PKMF10
SCHEMBL31334296 0.84 MAPK1 (0.46) MAPK1CCNT1
SCHEMBL31333401 0.84 MAPK1 (0.50) MAPK1CDK2
SCHEMBL31333711 0.82 MAPK1 (0.48) MAPK1CCNT1CCNKCCNE1CDK2
SCHEMBL31334180 0.80 CCNT1 (0.47) MAPK1CCNT1
SCHEMBL31334426 0.78 MAPK1 (0.49) MAPK1

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