SCHEMBL31332790

SCHEMBL31332790

CO[C@@](C)(CNC(=O)[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.37
RXFP1 Q9HBX9 1/20 0.36
GLA P06280 1/20 0.36
ALDH1A1 P00352 3/20 0.34
CHRM3 P20309 1/20 0.34
CTSK P43235 1/20 0.34
CTSL P07711 1/20 0.34
ITK Q08881 1/20 0.34
SLC6A3 Q01959 1/20 0.33
CHRM1 P11229 2/20 0.33
CHRM5 P08912 1/20 0.33
CACNA1H O95180 1/20 0.33
KCNH2 Q12809 1/20 0.33
CACNA1I Q9P0X4 1/20 0.33
SSTR4 P31391 1/20 0.33
GRM5 P41594 1/20 0.33

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
SCHEMBL31332624 0.96 TAAR1 (0.39) TAAR1RXFP1GLAALDH1A1CTSK
SCHEMBL31332732 0.96 TAAR1 (0.39) TAAR1RXFP1GLAALDH1A1CTSK
SCHEMBL31332891 0.82 SIGMAR1 (0.45) ALDH1A1
SCHEMBL31332854 0.82 SIGMAR1 (0.53) ALDH1A1
SCHEMBL31332729 0.79 SIGMAR1 (0.38) RXFP1
SCHEMBL31332657 0.78 EPHX2 (0.44) ALDH1A1
SCHEMBL31332872 0.78 EPHX2 (0.44) ALDH1A1
SCHEMBL31332799 0.77 POLB (0.53) ALDH1A1CHRM3CHRM1CACNA1HKCNH2
SCHEMBL31332801 0.76 EPHX2 (0.49)
SCHEMBL31332653 0.76 EPHX2 (0.49)

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