SCHEMBL31423391

SCHEMBL31423391

O=C1COc2cc(NC(=O)c3cccc(C(F)(F)F)c3Cl)ccc2N1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.56
CYP19A1 P11511 3/20 0.56
CYP2C9 P11712 2/20 0.56
KIF11 P52732 1/20 0.55
KMT2A Q03164 1/20 0.54
GRM5 P41594 1/20 0.53
TRPV1 Q8NER1 5/20 0.49
MALT1 Q9UDY8 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CYP1A2 P05177 2/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
DHODH Q02127 1/20 0.43
BRD4 O60885 1/20 0.43
CREBBP Q92793 1/20 0.43
PTPRC P08575 1/20 0.43
PTGS1 P23219 1/20 0.42
KCNK3 O14649 1/20 0.42
KCNK9 Q9NPC2 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
SCHEMBL31423372 0.82 KIF11 (0.53) KIF11TRPV1KCNK3KCNK9
SCHEMBL6804281 0.79 KIF11 (0.55) CYP3A4CYP19A1CYP2C9KIF11KMT2A
SCHEMBL31423363 0.77 MEN1 (0.64) KMT2ANPC1RAB9APTPRCPTGS1
SCHEMBL14073821 0.76 KMT2A (0.55) CYP3A4CYP19A1CYP2C9KIF11KMT2A
SCHEMBL14073885 0.76 KMT2A (0.55) CYP3A4CYP19A1CYP2C9KIF11KMT2A
SCHEMBL14073735 0.76 KMT2A (0.61) CYP3A4CYP19A1CYP2C9KIF11KMT2A
SCHEMBL14073832 0.76 KMT2A (0.57) CYP3A4CYP19A1CYP2C9KIF11KMT2A
SCHEMBL30444601 0.76 KMT2A (0.62) CYP3A4CYP19A1CYP2C9KIF11KMT2A
SCHEMBL22284864 0.75 CYP3A4 (0.79) CYP3A4CYP19A1CYP2C9KIF11KMT2A
SCHEMBL29478292 0.75 CYP3A4 (0.79) CYP3A4CYP19A1CYP2C9KIF11KMT2A

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
WO-2025057074-A1 N-ARYL BENZAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2025-03-20 WO claimed
WO-2025057074-A1 N-ARYL BENZAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2025-03-20 WO disclosed