SCHEMBL11233680

SCHEMBL11233680

CC(=O)COc1ccc(N2CC(CO)OC2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.52
▸ MAOB P27338 1/20 0.52
▸ GRM2 Q14416 10/20 0.52
▸ CALML3 P27482 2/20 0.46
▸ SIGMAR1 Q99720 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
SCHEMBL9482868 0.88 GRM2 (0.50) MAOAMAOBGRM2CALML3SIGMAR1
SCHEMBL9482871 0.88 GRM2 (0.50) MAOAMAOBGRM2CALML3SIGMAR1
SCHEMBL9482719 0.83 GRM2 (0.51) MAOAMAOBGRM2CALML3
SCHEMBL9482721 0.83 GRM2 (0.51) MAOAMAOBGRM2CALML3
SCHEMBL1223001 0.83 GRM2 (0.67) MAOAMAOBGRM2SIGMAR1
SCHEMBL1223003 0.83 GRM2 (0.67) MAOAMAOBGRM2SIGMAR1
SCHEMBL9482693 0.81 GRM2 (0.53) MAOAMAOBGRM2CALML3SIGMAR1
SCHEMBL9484141 0.81 GRM2 (0.53) MAOAMAOBGRM2CALML3SIGMAR1
SCHEMBL9482678 0.81 GRM2 (0.53) MAOAMAOBGRM2CALML3SIGMAR1
SCHEMBL9484138 0.81 GRM2 (0.53) MAOAMAOBGRM2CALML3SIGMAR1

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-4338451-A ANTIDEPRESSANTS DELALANDE S.A. (FR) 1982-07-06 — — US disclosed
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