SCHEMBL19496818

SCHEMBL19496818

CN(C)Cc1cccc(-c2ccc(N3CCN(C)CC3)nc2)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 7/20 0.52
▸ FYN P06241 2/20 0.49
▸ PRMT5 O14744 1/20 0.48
▸ WDR77 Q9BQA1 1/20 0.48
▸ CNR2 P34972 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ TNKS O95271 3/20 0.47
▸ SMO Q99835 1/20 0.47
▸ MAP4K1 Q92918 1/20 0.46
▸ HTR3A P46098 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
SCHEMBL19497006 0.88 NTRK1 (0.53) AOC3CNR2SMOMAP4K1
SCHEMBL19496801 0.84 AOC3 (0.59) AOC3CNR2TNKSSMO
SCHEMBL11364473 0.83 AOC3 (0.74) AOC3
SCHEMBL22792254 0.82 SMO (0.56) SMOMAP4K1HTR3A
SCHEMBL19496775 0.81 AOC3 (0.59) AOC3CNR2SMO
SCHEMBL15344195 0.81 FYN (0.53) FYNPRMT5WDR77CNR2TNKS
SCHEMBL19496840 0.81 AOC3 (0.52) AOC3
SCHEMBL19496568 0.81 AOC3 (0.52) AOC3
SCHEMBL19496641 0.81 AOC3 (0.52) AOC3
SCHEMBL19496981 0.81 AOC3 (0.49) AOC3CNR2SMO

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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