SCHEMBL19496981

SCHEMBL19496981

CN(C)Cc1cccc(-c2ccc(N3CCC(c4ccncc4)CC3)nc2)c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 11/20 0.49
▸ LMNA P02545 1/20 0.41
▸ FASN P49327 2/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ SMO Q99835 2/20 0.39
▸ USP30 Q70CQ3 2/20 0.38
▸ AVPR1A P37288 1/20 0.38

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
SCHEMBL11363893 0.86 AOC3 (0.69) AOC3
SCHEMBL19496809 0.84 DGAT1 (0.50) AOC3CNR2SMOAVPR1A
SCHEMBL19496818 0.81 AOC3 (0.52) AOC3CNR2SMO
SCHEMBL11356497 0.79 AOC3 (0.52) AOC3
SCHEMBL19497006 0.79 NTRK1 (0.53) AOC3CNR2SMO
SCHEMBL11362907 0.77 AOC3 (0.83) AOC3
SCHEMBL19496801 0.76 AOC3 (0.59) AOC3CNR2SMO
SCHEMBL19496775 0.76 AOC3 (0.59) AOC3CNR2SMO
SCHEMBL11364133 0.75 AOC3 (0.84) AOC3
SCHEMBL19496724 0.74 AOC3 (0.47) AOC3CNR2

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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