SCHEMBL31332672

SCHEMBL31332672

COC(C)(CNC(=O)Nc1cccc(OC(F)(F)F)c1)c1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 1/20 0.50
CNR1 P21554 1/20 0.49
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
NAMPT P43490 1/20 0.45
HTT P42858 1/20 0.44
MCHR1 Q99705 1/20 0.44
CETP P11597 1/20 0.44
EPHX2 P34913 1/20 0.44
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
RAF1 P04049 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL31332681 0.90 HTT (0.55) CNR1RAB9ANPC1HTTLMNA
SCHEMBL31332621 0.90 HTT (0.55) CNR1RAB9ANPC1HTTLMNA
SCHEMBL31332735 0.87 FADS1 (0.47) RAB9ANPC1HTTLMNARAF1
SCHEMBL31332776 0.84 ALDH1A1 (0.51) CNR1RAB9ANPC1HTTLMNA
SCHEMBL29555891 0.79 P2RX1 (0.67) P2RX1CNR1RAB9ANPC1HTT
SCHEMBL14559559 0.75 NAMPT (0.56) P2RX1CNR1RAB9ANPC1NAMPT
SCHEMBL13491774 0.74 CETP (0.78) CNR1NAMPTHTTCETPEPHX2
SCHEMBL31332818 0.73 EPHX1 (0.50) EPHX2
SCHEMBL29556261 0.73 P2RX1 (0.62) P2RX1CNR1RAB9ANPC1HTT
SCHEMBL31332799 0.72 POLB (0.53) RAB9ANPC1HTTEPHX2POLB

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