SCHEMBL31332732

SCHEMBL31332732

CO[C@@](C)(CNC(=O)[C@@H]1C[C@H]1C1CCCC1)c1cccc(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.39
GLA P06280 1/20 0.39
ITK Q08881 1/20 0.39
CTSK P43235 1/20 0.37
CTSL P07711 1/20 0.37
RXFP1 Q9HBX9 1/20 0.35
EPHX2 P34913 2/20 0.34
EPHX1 P07099 1/20 0.34
F2 P00734 1/20 0.34
GRM5 P41594 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CCKBR P32239 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 1.00 TAAR1 (0.39) TAAR1GLAITKCTSKCTSL
SCHEMBL31332790 0.96 TAAR1 (0.37) TAAR1GLAITKCTSKCTSL
SCHEMBL31332891 0.80 SIGMAR1 (0.45) ALDH1A1L3MBTL1
SCHEMBL31332854 0.80 SIGMAR1 (0.53) ALDH1A1
SCHEMBL31332653 0.79 EPHX2 (0.49) EPHX2EPHX1L3MBTL1
SCHEMBL31332801 0.79 EPHX2 (0.49) EPHX2EPHX1L3MBTL1
SCHEMBL31332613 0.78 ALDH1A1 (0.46) EPHX2EPHX1F2ALDH1A1GAA
SCHEMBL31332706 0.78 EPHX2 (0.53) EPHX2EPHX1ALDH1A1GAAL3MBTL1
SCHEMBL31332705 0.78 EPHX1 (0.54) EPHX2EPHX1F2ALDH1A1GAA
SCHEMBL31332634 0.78 EPHX1 (0.54) EPHX2EPHX1F2ALDH1A1GAA

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