SCHEMBL3375919

SCHEMBL3375919

O=C[C@@H]1CN(C(=O)O)C[C@H]1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 1/20 0.30

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
SCHEMBL17747764 1.00 GABRR1 (0.30) GABRR1
SCHEMBL4600592 0.79 GABRR1 (0.39) GABRR1
SCHEMBL17747646 0.79
SCHEMBL2541422 0.75 DPP4 (0.30)
SCHEMBL18340860 0.75 DPP4 (0.30)
SCHEMBL3183946 0.71 GABRR1 (0.33) GABRR1
SCHEMBL3197102 0.71 GABRR1 (0.33) GABRR1
SCHEMBL15193898 0.71 GABRR1 (0.33) GABRR1
SCHEMBL15194169 0.71 GABRR1 (0.33) GABRR1
SCHEMBL321958 0.70

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-1863477-B1 3,4-SUBSTITUTED PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF HYPERTENSION NOVARTIS AG (CH) 2010-11-03 EP disclosed