SCHEMBL31334606

SCHEMBL31334606

NC(=O)C1CCCC(Nc2ncc(F)c(-c3cccc(C4(O)COC4)c3)n2)C1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 5/20 0.40
MAPK8 P45983 2/20 0.37
ADORA1 P30542 1/20 0.36
CTSA P10619 1/20 0.36
MAPK1 P28482 6/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CDK7 P50613 2/20 0.35
CD38 P28907 1/20 0.35
DYRK2 Q92630 1/20 0.35
BTK Q06187 1/20 0.34
SYK P43405 1/20 0.34

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
SCHEMBL31334884 0.92 MAPK3 (0.43) MAPK3MAPK8ADORA1CTSAMAPK1
SCHEMBL31333196 0.91 MAPK3 (0.42) MAPK3ADORA1CTSAMAPK1CCNA2
SCHEMBL31334409 0.90 IRAK1 (0.42) MAPK3MAPK8ADORA1CTSAMAPK1
SCHEMBL31333422 0.85 MAPK3 (0.44) MAPK3MAPK8ADORA1MAPK1CCNA2
SCHEMBL31334596 0.84 ADORA1 (0.41) MAPK3ADORA1CTSAMAPK1CCNA2
SCHEMBL31334502 0.83 MAPK3 (0.39) MAPK3MAPK8ADORA1MAPK1CCNA2
SCHEMBL31334771 0.82 SYK (0.42) MAPK3MAPK8ADORA1MAPK1CDK2
SCHEMBL31334522 0.82 CTSA (0.41) MAPK3ADORA1CTSAMAPK1CCNA2
SCHEMBL31333489 0.82 MAPK8 (0.44) MAPK3MAPK8ADORA1CTSAMAPK1
SCHEMBL31334543 0.80 SYK (0.44) MAPK3MAPK1CCNA2CDK2CDK7

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