SCHEMBL28929968

SCHEMBL28929968

COc1ccc(-c2nc(C)nc(Nc3ccc(OC(F)(F)F)cc3)n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 11/20 1.00
▸ GALR2 O43603 2/20 0.50
▸ GALR1 P47211 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ KCNH2 Q12809 1/20 0.45
▸ SCN5A Q14524 1/20 0.45
▸ SCN9A Q15858 1/20 0.45
▸ RORC P51449 1/20 0.45
▸ DHFR P00374 1/20 0.45

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 0.89 CHRNA7 (1.00) CHRNA7GALR2GALR1MEN1GAA
SCHEMBL30149873 0.86 CHRNA7 (1.00) CHRNA7GALR2GALR1MEN1GAA
SCHEMBL28929970 0.86 CHRNA7 (1.00) CHRNA7MAPTSMN1; SMN2
SCHEMBL28929971 0.84 CHRNA7 (1.00) CHRNA7GALR2GALR1MEN1KMT2A
SCHEMBL28929963 0.83 CHRNA7 (0.78) CHRNA7GALR2GALR1RORC
SCHEMBL30149861 0.82 CHRNA7 (1.00) CHRNA7GALR2MEN1GAAKMT2A
SCHEMBL28929972 0.82 CHRNA7 (1.00) CHRNA7GALR2GALR1MEN1GAA
SCHEMBL28929969 0.82 CHRNA7 (1.00) CHRNA7GALR2GALR1MAPTRORC
SCHEMBL28929967 0.81 CHRNA7 (0.76) CHRNA7GALR2GALR1MEN1KMT2A
SCHEMBL29069335 0.79 CHRNA7 (0.88) CHRNA7KCNH2SCN5ASCN9ADHFR

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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