SCHEMBL31333475

SCHEMBL31333475

CC(C)(C)OC(=O)N[C@H]1CC[C@H](N2CC=C(c3ccc([N+](=O)[O-])cc3F)C(F)(F)C2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 3/20 0.44
▸ GPR119 Q8TDV5 5/20 0.35
▸ CCRL2 O00421 1/20 0.34
▸ MAPT P10636 3/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ JAK1 P23458 2/20 0.33
▸ KDM1A O60341 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ JAK2 O60674 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CTDSP1 Q9GZU7 1/20 0.32

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
SCHEMBL31334454 0.83 DRD2 (0.49) DRD2GPR119CCRL2MAPTMEN1
SCHEMBL31334845 0.78 ALDH1A1 (0.45) GPR119MAPTKMT2AALDH1A1ALOX5AP
SCHEMBL31333664 0.77 DRD2 (0.51) DRD2MAPTMEN1KMT2AALDH1A1
SCHEMBL31333847 0.74 DRD2 (0.58) DRD2ALDH1A1JAK1JAK2
SCHEMBL13419542 0.73 DRD2 (0.54) DRD2MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL30915181 0.73 DRD2 (0.54) DRD2MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL13419626 0.72 DRD2 (0.51) DRD2GPR119MAPTMEN1KMT2A
SCHEMBL31333302 0.71 DRD2 (0.42) DRD2CCRL2MAPTMEN1CRHBP
SCHEMBL31333384 0.71 DRD2 (0.45) DRD2MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL30817389 0.70 MEN1 (0.60) DRD2MAPTMEN1KMT2AALDH1A1

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
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