SCHEMBL19496723

SCHEMBL19496723

CC1CN(c2ccc(-c3cccc(CN(C)C)c3)cc2)CC(C)O1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 9/20 0.52
▸ TAAR1 Q96RJ0 2/20 0.43
▸ HTR7 P34969 1/20 0.42
▸ GRM2 Q14416 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ WNT3A P56704 1/20 0.38
▸ NMT1 P30419 1/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL11360494 0.83 AOC3 (0.75) AOC3
SCHEMBL19496721 0.78 AOC3 (0.58) AOC3
SCHEMBL19496954 0.76 AOC3 (0.56) AOC3TAAR1MAPTSMN1; SMN2
SCHEMBL11358644 0.76 AOC3 (0.55) AOC3
SCHEMBL19496853 0.72 AOC3 (0.60) AOC3MAPTSMN1; SMN2WNT3A
SCHEMBL29864624 0.72 TAAR1 (0.67) AOC3TAAR1HTR7TSHRNMT1
SCHEMBL3464184 0.72 TAAR1 (0.67) AOC3TAAR1HTR7TSHRNMT1
SCHEMBL19496746 0.71 AOC3 (0.59) AOC3
SCHEMBL6132474 0.70 MAPT (0.55) MAPTTSHRSMN1; SMN2WNT3A
SCHEMBL6132477 0.70 MAPT (0.55) MAPTTSHRSMN1; SMN2WNT3A

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
Send feedback