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Sugi Predict / Compounds / SCHEMBL30016367

SCHEMBL30016367

SCHEMBL30016367

O=C(O)c1ccc(NC(=O)c2ccc3c(c2)N(S(=O)(=O)c2cccc(Cl)c2)CCS3)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CPT1A P50416 17/20 1.00
▸ CPT1B Q92523 15/20 1.00
▸ CPT2 P23786 12/20 1.00
▸ KDM4E B2RXH2 1/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ PPARG P37231 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ NR2E3 Q9Y5X4 1/20 0.55
▸ NCOR2 Q9Y618 1/20 0.55
▸ MAPT P10636 2/20 0.55

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
SCHEMBL751881 1.00 CPT1A (1.00) CPT1ACPT1BCPT2KDM4ENPC1
SCHEMBL751878 0.89 CPT1A (0.80) CPT1ACPT1BCPT2MAPT
SCHEMBL751968 0.87 CPT1A (0.77) CPT1ACPT1BCPT2KDM4ENPC1
SCHEMBL27751900 0.86 CPT1A (0.75) CPT1ACPT1BCPT2KDM4ENPC1
SCHEMBL30016318 0.84 CPT1A (1.00) CPT1ACPT1BCPT2KDM4ENPC1
SCHEMBL752359 0.84 CPT1A (1.00) CPT1ACPT1BCPT2KDM4ENPC1
SCHEMBL3567632 0.83 CPT1A (0.74) CPT1ACPT1BCPT2MAPT
SCHEMBL30014628 0.83 CPT1A (0.74) CPT1ACPT1BCPT2MAPT
SCHEMBL755264 0.82 CPT1A (0.69) CPT1ACPT1BCPT2KDM4ENPC1
SCHEMBL752922 0.81 CPT1A (1.00) CPT1ACPT1BCPT2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022212568-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING LIPID METABOLISM 1BASE PHARMACEUTICALS, LLC (US) 2022-10-06 — — WO disclosed