SCHEMBL31334812

SCHEMBL31334812

O=C1COCCN1c1cccc(-c2nc(N[C@H]3CC[C@H](O)CC3)ncc2F)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 5/20 0.46
ADORA1 P30542 4/20 0.44
MAPK1 P28482 4/20 0.43
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
MAPK3 P27361 1/20 0.43
PIK3CD O00329 3/20 0.42
ADORA2A P29274 3/20 0.42
ADORA2B P29275 1/20 0.42
PTGS2 P35354 1/20 0.41
PIK3CA P42336 2/20 0.41
PIK3CG P48736 2/20 0.41
PIK3CB P42338 1/20 0.40
NTRK1 P04629 1/20 0.40
MAPK8 P45983 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39

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
SCHEMBL31333681 0.91 MAP4K1 (0.46) MAP4K1MAPK1CCNA2CDK2MAPK3
SCHEMBL31333841 0.91 MAP4K1 (0.44) MAP4K1MAPK1CCNA2CDK2MAPK3
SCHEMBL31334927 0.90 MAP4K1 (0.45) MAP4K1MAPK1CCNA2CDK2MAPK3
SCHEMBL31334836 0.90 MAP4K1 (0.43) MAP4K1MAPK1CCNA2CDK2MAPK3
SCHEMBL31334815 0.90 MAP4K1 (0.45) MAP4K1MAPK1CCNA2CDK2MAPK3
SCHEMBL31333902 0.90 MAP4K1 (0.43) MAP4K1MAPK1CCNA2CDK2MAPK3
SCHEMBL31333633 0.90 MAP4K1 (0.47) MAP4K1MAPK1CCNA2CDK2MAPK3
SCHEMBL31334161 0.88 MAPK1 (0.46) MAP4K1MAPK1CCNA2CDK2MAPK3
SCHEMBL31333712 0.87 SYK (0.47) ADORA1MAPK1CDK2ADORA2AADORA2B
SCHEMBL31334186 0.86 PIK3CA (0.47) ADORA1MAPK1CCNA2CDK2MAPK3

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