SCHEMBL31332799

SCHEMBL31332799

COC(C)(CNC(=O)NCC1CC1)c1cccc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
FBP1 P09467 1/20 0.49
EPHX1 P07099 1/20 0.47
EPHX2 P34913 1/20 0.47
KCNH2 Q12809 1/20 0.45
CACNA1I Q9P0X4 1/20 0.45
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
GAA P10253 2/20 0.41
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TP53 P04637 3/20 0.40
MAPT P10636 3/20 0.40
HTT P42858 2/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
PTGIR P43119 1/20 0.39
USP30 Q70CQ3 1/20 0.39
CACNA1H O95180 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL31332705 0.96 EPHX1 (0.54) POLBFBP1EPHX1EPHX2KCNH2
SCHEMBL31332634 0.96 EPHX1 (0.54) POLBFBP1EPHX1EPHX2KCNH2
SCHEMBL31332801 0.83 EPHX2 (0.49) EPHX1EPHX2NPC1RAB9AL3MBTL1
SCHEMBL31332653 0.83 EPHX2 (0.49) EPHX1EPHX2NPC1RAB9AL3MBTL1
SCHEMBL31332620 0.81 EPHX2 (0.40) POLBEPHX1EPHX2NPC1RAB9A
SCHEMBL31332818 0.81 EPHX1 (0.50) EPHX1EPHX2MAPT
SCHEMBL31332706 0.80 EPHX2 (0.53) POLBEPHX1EPHX2NPC1RAB9A
SCHEMBL31332613 0.80 ALDH1A1 (0.46) POLBEPHX1EPHX2NPC1RAB9A
SCHEMBL31332728 0.78 IDH1 (0.44) POLBFBP1EPHX2NPC1RAB9A
SCHEMBL31332632 0.78 LMNA (0.50) POLBNPC1RAB9AGAAALDH1A1

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