SCHEMBL30149861

SCHEMBL30149861

CCCNc1nc(Nc2ccc(OC(F)(F)F)cc2)nc(-c2ccc(OC)cc2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 11/20 1.00
▸ MERTK Q12866 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.50
▸ KCNH3 Q9ULD8 2/20 0.49
▸ GALR2 O43603 1/20 0.46
▸ NR1I2 O75469 1/20 0.45
▸ AHR P35869 1/20 0.45
▸ CNR2 P34972 1/20 0.44
▸ GBA1 P04062 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL30149855 0.86 CHRNA7 (1.00) CHRNA7KCNH3GALR2MEN1GAA
SCHEMBL28929969 0.84 CHRNA7 (1.00) CHRNA7ALDH1A1GALR2
SCHEMBL28929971 0.84 CHRNA7 (1.00) CHRNA7ALDH1A1GALR2MEN1KMT2A
SCHEMBL28929968 0.82 CHRNA7 (1.00) CHRNA7GALR2MEN1GAAKMT2A
SCHEMBL28929970 0.81 CHRNA7 (1.00) CHRNA7
SCHEMBL30149873 0.81 CHRNA7 (1.00) CHRNA7ALDH1A1GALR2MEN1GAA
SCHEMBL28929963 0.81 CHRNA7 (0.78) CHRNA7GALR2
SCHEMBL16370652 0.80 CHRNA7 (0.66) CHRNA7CNR2
SCHEMBL28929972 0.78 CHRNA7 (1.00) CHRNA7GALR2MEN1GAAKMT2A
SCHEMBL17510065 0.76 CNR2 (0.71) CHRNA7CNR2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115554302-A Application of 6-phenyl-triazine-2-amine compound in preparation of medicine for improving cognitive disorder of nervous system 北京大学 2023-01-03 — — CN disclosed
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