SCHEMBL31488932

SCHEMBL31488932

NS(=O)(=O)N1CC=C(c2ccc(NC(=O)N3Cc4cc(F)cnc4C3)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 19/20 0.56
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
CASP3 P42574 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45

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
SCHEMBL31488960 0.93 NAMPT (0.58) NAMPT
SCHEMBL31489061 0.87 NAMPT (0.54) NAMPT
SCHEMBL31488877 0.86 NAMPT (0.61) NAMPTNPC1ALDH1A1MAPTHPGD
SCHEMBL31488938 0.85 NAMPT (0.50) NAMPT
SCHEMBL31488867 0.83 NAMPT (0.68) NAMPT
Hydrochloric Acid SCHEMBL31489161 0.81 NAMPT (0.53) NAMPT
SCHEMBL31488984 0.81 NAMPT (0.70) NAMPT
SCHEMBL31489122 0.79 NAMPT (0.66) NAMPT
SCHEMBL31489053 0.79 NAMPT (0.61) NAMPT
SCHEMBL31488807 0.78 NAMPT (0.51) NAMPTNPC1RAB9A

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-2025072437-A1 HETEROARYL COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS ALPHINA THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed