SCHEMBL31333899

SCHEMBL31333899

O=C1OCCCN1c1cccc(B(O)O)n1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 4/20 0.37
PIM1 P11309 4/20 0.37
TYK2 P29597 1/20 0.36
PIK3CA P42336 4/20 0.34
PIK3CD O00329 4/20 0.33
PIK3CB P42338 3/20 0.33
HTR1A P08908 1/20 0.32
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
TNKS O95271 1/20 0.32
ATR Q13535 1/20 0.32
ATRIP Q8WXE1 1/20 0.32
CMA1 P23946 1/20 0.31
KDM1A O60341 1/20 0.31

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
SCHEMBL31334558 0.78 ALOX5 (0.43) IDH1PIM1TYK2PIK3CAPIK3CD
SCHEMBL19994425 0.78 ALOX5 (0.43) IDH1PIM1TYK2PIK3CAPIK3CD
SCHEMBL31334907 0.77 PARP1 (0.44) IDH1PIM1TYK2
SCHEMBL31334702 0.75 MAP4K1 (0.41) TYK2PIK3CAPIK3CDPIK3CB
SCHEMBL31334843 0.74 ATR (0.37) IDH1PIM1PIK3CAPIK3CDATR
SCHEMBL15845752 0.71 HSD11B1 (0.42)
SCHEMBL31334922 0.70 IDH1 (0.36) IDH1PIM1TYK2PIK3CAPIK3CD
SCHEMBL15845742 0.70 GAA (0.51) PIK3CAPIK3CD
SCHEMBL20689588 0.70 TYK2 (0.45) IDH1PIM1TYK2TNKS
SCHEMBL31262446 0.70 TYK2 (0.45) IDH1PIM1TYK2TNKS

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