SCHEMBL31409403

SCHEMBL31409403

FC(F)(F)c1nc2c(o1)CNCC2

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
GABRA1 P14867 1/20 0.31
CYP2C19 P33261 1/20 0.31
GABRB2 P47870 1/20 0.31
KMT2A Q03164 1/20 0.31
ELANE P08246 1/20 0.30
GMNN O75496 1/20 0.30
BLM P54132 1/20 0.30

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
SCHEMBL31409364 0.86 HTR6 (0.30) ELANE
SCHEMBL20329007 0.82 HTR2A (0.35) MEN1GABRA1CYP2C19GABRB2KMT2A
SCHEMBL24303590 0.76 CHRM3 (0.31)
SCHEMBL16220577 0.73 MEN1 (0.34) MEN1GABRA1CYP2C19GABRB2KMT2A
SCHEMBL20333664 0.72 CHRM5 (0.33)
SCHEMBL19042352 0.72 MEN1 (0.33) MEN1GABRA1CYP2C19GABRB2KMT2A
SCHEMBL16380132 0.72 MEN1 (0.33) MEN1GABRA1CYP2C19GABRB2KMT2A
SCHEMBL3337356 0.72 PDCD1 (0.35) MEN1GABRA1CYP2C19GABRB2KMT2A
Hydrochloric Acid SCHEMBL15021048 0.70 PDCD1 (0.35) MEN1GABRA1CYP2C19GABRB2KMT2A
SCHEMBL19131408 0.69 CHRNB2 (0.35) MEN1GABRA1CYP2C19GABRB2KMT2A

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-2025038920-A1 HETEROARYL AMINE COMPOUNDS AND USES THEREOF XENON PHARMACEUTICALS, INC. (CA) 2025-02-20 WO disclosed
WO-2025038917-A1 HETEROARYL AMINE COMPOUNDS AND USES THEREOF XENON PHARMACEUTICALS INC. (CA) 2025-02-20 WO disclosed