SCHEMBL31334702

SCHEMBL31334702

O=C1COCCN1c1cccc(B(O)O)n1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 2/20 0.41
JAK2 O60674 1/20 0.39
TYK2 P29597 1/20 0.39
PTGS2 P35354 11/20 0.39
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
PIK3CD O00329 3/20 0.36
PIK3CA P42336 2/20 0.36
PIK3CB P42338 2/20 0.36
PIK3CG P48736 2/20 0.36
F10 P00742 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
SCHEMBL30165670 0.78 MAP4K1 (0.43) MAP4K1JAK2TYK2PTGS2CYP3A4
SCHEMBL19994364 0.78 MAP4K1 (0.43) MAP4K1JAK2TYK2PTGS2CYP3A4
SCHEMBL30165667 0.78 MAP4K1 (0.43) MAP4K1JAK2TYK2PTGS2CYP3A4
SCHEMBL25676559 0.78 MAP4K1 (0.46) MAP4K1PTGS2CYP3A4CYP2D6CYP2C9
SCHEMBL31334907 0.77 PARP1 (0.44) MAP4K1JAK2TYK2CYP3A4CYP2D6
SCHEMBL15845742 0.76 GAA (0.51) PIK3CDPIK3CA
SCHEMBL31333899 0.75 IDH1 (0.37) TYK2PIK3CDPIK3CAPIK3CB
SCHEMBL28894717 0.75 PTGS2 (0.36) MAP4K1JAK2TYK2PTGS2CYP2C9
SCHEMBL31334661 0.74 RAF1 (0.40) MAP4K1JAK2TYK2PTGS2CYP3A4
SCHEMBL6405329 0.72 CRBN (0.49) MAP4K1JAK2PTGS2

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