SCHEMBL7550571

SCHEMBL7550571

NCc1ccc(C(C(N)=O)C2CCc3cc(Cl)cc4[nH]c(C(=O)O)c2c34)c(C(=O)O)c1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 5/20 0.33
GPR17 Q13304 2/20 0.31
FBP1 P09467 1/20 0.31
MDM2 Q00987 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
SCHEMBL7553550 0.90 GPR17 (0.31) GPR17
Hydrochloric Acid SCHEMBL7554193 0.88 GRIN1 (0.32) GRIN1GPR17FBP1MDM2
SCHEMBL7548266 0.88 GPR17 (0.39) GRIN1GPR17FBP1
SCHEMBL7549048 0.87 PTGDR (0.32) GRIN1GPR17FBP1
Hydrochloric Acid SCHEMBL7547498 0.86 PTGDR (0.32) GRIN1GPR17FBP1
SCHEMBL7551403 0.85 GPR17 (0.35) GRIN1GPR17FBP1
SCHEMBL7551083 0.83 ACE2 (0.33)
SCHEMBL7550579 0.76 GRIN1 (0.36) GRIN1GPR17FBP1
SCHEMBL7548907 0.76 L3MBTL1 (0.32) GRIN1MDM2
SCHEMBL7550574 0.69 KDM4E (0.32) GRIN1GPR17

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