SCHEMBL7554385

SCHEMBL7554385

COC(=O)c1[nH]c2cc(Cl)cc3c2c1C(CC(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1CCCCC(=O)O)CC3

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GLS O94925 2/20 0.30
MTNR1A P48039 2/20 0.30
MTNR1B P49286 2/20 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
SCHEMBL7555174 0.93 MTNR1A (0.34) MTNR1AMTNR1B
SCHEMBL7550462 0.92 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL7550440 0.90 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL7547267 0.89 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL7548909 0.88 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL7548639 0.88 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL7549043 0.87 MTNR1A (0.33) MTNR1AMTNR1B
SCHEMBL7548916 0.86 GRIN1 (0.32)
SCHEMBL7550864 0.85 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL7551122 0.84 MTNR1A (0.32) MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0657427-B1 Tricyclic indole-2-carboxylic acid derivatives being selective antagonists of the NMDA receptor SUMITOMO PHARMA (JP) 2002-06-19 EP disclosed
US-5496843-A Tricyclic indole-2-carboxylic acid derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-03-05 US disclosed
EP-0657427-A1 Tricyclic indole-2-carboxylic acid derivatives being selective antagonists of the NMDA receptor SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1995-06-14 EP disclosed