SCHEMBL9484138

SCHEMBL9484138

C[C@H](O)CCOc1ccc(N2C[C@H](CO)OC2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 10/20 0.53
▸ MAOA P21397 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ CALML3 P27482 2/20 0.44
▸ SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL9482678 1.00 GRM2 (0.53) GRM2MAOAMAOBCALML3SIGMAR1
SCHEMBL9482685 1.00 GRM2 (0.53) GRM2MAOAMAOBCALML3SIGMAR1
SCHEMBL9482693 1.00 GRM2 (0.53) GRM2MAOAMAOBCALML3SIGMAR1
SCHEMBL9484141 1.00 GRM2 (0.53) GRM2MAOAMAOBCALML3SIGMAR1
SCHEMBL9463722 0.88 GRM2 (0.57) GRM2MAOB
SCHEMBL9463584 0.88 GRM2 (0.57) GRM2MAOB
SCHEMBL9463553 0.88 GRM2 (0.57) GRM2MAOB
SCHEMBL9483405 0.88 GRM2 (0.57) GRM2MAOB
SCHEMBL9482826 0.88 GRM2 (0.57) GRM2MAOB
SCHEMBL9463172 0.88 GRM2 (0.57) GRM2MAOB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5196543-A Antidepressants, tranquilizers DELALANDE S.A. (FR) 1993-03-23 — — US disclosed
US-5036091-A Psychotropic drugs DELALANDE S.A. (FR) 1991-07-30 — — US disclosed
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