SCHEMBL31332891

SCHEMBL31332891

COC(C)(CNC(=O)C1CC1c1ccc(Cl)cc1)c1cccc(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.45
DGAT2 Q96PD7 1/20 0.43
HTT P42858 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 2/20 0.41
NAMPT P43490 1/20 0.40
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL31332854 0.94 SIGMAR1 (0.53) SIGMAR1DGAT2ALDH1A1LMNAMEN1
SCHEMBL31332805 0.86 NAMPT (0.53) SIGMAR1DGAT2NAMPT
SCHEMBL31332729 0.84 SIGMAR1 (0.38) SIGMAR1LMNAMEN1KMT2A
SCHEMBL31332790 0.82 TAAR1 (0.37) ALDH1A1
SCHEMBL31332624 0.80 TAAR1 (0.39) ALDH1A1L3MBTL1
SCHEMBL31332732 0.80 TAAR1 (0.39) ALDH1A1L3MBTL1
SCHEMBL31332715 0.79 SIGMAR1 (0.50) SIGMAR1DGAT2HTTALDH1A1LMNA
SCHEMBL31332717 0.77 SIGMAR1 (0.53) SIGMAR1HTTALDH1A1TDP1LMNA
SCHEMBL31332799 0.76 POLB (0.53) HTTALDH1A1POLBL3MBTL1MEN1
SCHEMBL5675747 0.73 ALDH1A1 (0.49) DGAT2ALDH1A1LMNANAMPTTP53

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-4709708-A1 NOVEL CARBOXAMIDE DERIVATIVES ANGELINI PHARMA S.P.A. (IT) 2026-03-18 EP disclosed
WO-2024233603-A1 NOVEL CARBOXAMIDE DERIVATIVES ICAGEN, LLC (US) 2024-11-14 WO disclosed