SCHEMBL8436019

SCHEMBL8436019

CC(C(N)=O)C1CN(c2ccccc2)C(=O)O1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 17/20 0.46
FADS1 O60427 1/20 0.44
F10 P00742 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL8501013 0.85 FADS1 (0.53) GRM2FADS1MAOAMAOB
SCHEMBL28109789 0.82 MAOB (0.51) F10MAOAMAOB
SCHEMBL28110356 0.81 MAOA (0.47) GRM2MAOAMAOB
SCHEMBL27481286 0.81 MAOA (0.47) GRM2MAOAMAOB
SCHEMBL5571718 0.81 MAOA (0.41) GRM2FADS1MAOAMAOB
SCHEMBL5198029 0.79 MAOA (0.45) F10MAOAMAOB
SCHEMBL27573655 0.79 MAOA (0.45) F10MAOAMAOB
SCHEMBL6233214 0.79 MAOA (0.45) F10MAOAMAOB
SCHEMBL6233210 0.79 MAOA (0.45) F10MAOAMAOB
SCHEMBL28079570 0.77 MAOA (0.43) F10MAOAMAOB

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
US-5929083-A CONTAINING 3-AZABICYCLO(3.1.1)HEPTANE GROUPS CHEIL JEDANG CORPORATION (KR) 1999-07-27 US disclosed