SCHEMBL7549055

SCHEMBL7549055

CC(C(=O)Nc1ccc(N)cc1OCC(=O)O)C1CCc2cc(Cl)cc3[nH]c(C(=O)O)c1c23

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.33
PTGS2 P35354 1/20 0.33
PPARD Q03181 7/20 0.32
PPARA Q07869 3/20 0.31
PPARG P37231 2/20 0.31
GPR17 Q13304 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
Hydrochloric Acid SCHEMBL7547508 0.99 PTGES (0.33) PTGESPTGS2PPARDPPARAPPARG
SCHEMBL7551089 0.92 MAPK1 (0.35)
SCHEMBL7555556 0.87 GPR17 (0.33) PTGS2GPR17
SCHEMBL7550574 0.86 KDM4E (0.32) GPR17
SCHEMBL7550091 0.86 NR1I3 (0.32) PTGESPTGS2
Hydrochloric Acid SCHEMBL7554197 0.86 GPR17 (0.32) GPR17
SCHEMBL7548270 0.85 GPR17 (0.37) PTGESPTGS2GPR17
SCHEMBL7551410 0.84 GPR17 (0.34) PTGESGPR17
SCHEMBL7553553 0.77 MEN1 (0.30)
SCHEMBL7547397 0.76 CNR1 (0.32)

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