SCHEMBL19496954

SCHEMBL19496954

CCN1CCN(c2ccc(-c3cccc(CN(C)C)c3)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 7/20 0.56
▸ CHRNA7 P36544 1/20 0.50
▸ GAA P10253 2/20 0.48
▸ RAD52 P43351 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ GFER P55789 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ FGFR1 P11362 1/20 0.46
▸ FGFR2 P21802 1/20 0.46
▸ MAP4K1 Q92918 1/20 0.45
▸ TAAR1 Q96RJ0 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ CHKA P35790 2/20 0.43

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
SCHEMBL19496725 0.83 GAA (0.54) AOC3CHRNA7GAARAD52KDM4E
SCHEMBL11364522 0.82 AOC3 (0.84) AOC3
SCHEMBL19496853 0.82 AOC3 (0.60) AOC3GAAMAPTGFERSMN1; SMN2
SCHEMBL12319455 0.79 CHRNA7 (0.79) CHRNA7GAARAD52KDM4EMAPT
SCHEMBL10318103 0.79 AOC3 (0.62) AOC3MEN1KMT2A
SCHEMBL19496722 0.77 AOC3 (0.62) AOC3
SCHEMBL19496723 0.76 AOC3 (0.52) AOC3MAPTSMN1; SMN2TAAR1
SCHEMBL19496553 0.75 AOC3 (0.59) AOC3
SCHEMBL19496700 0.74 AOC3 (0.58) AOC3
SCHEMBL3464184 0.74 TAAR1 (0.67) AOC3TAAR1CHKA

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
EP-2479165-B1 GLYCINE COMPOUND ASTELLAS PHARMA INC (JP) 2017-10-25 — — EP disclosed
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