SCHEMBL7549065

SCHEMBL7549065

NCc1ccc(NC(=O)CC2CCc3cc(Cl)cc4[nH]c(C(=O)O)c2c34)c(OCC(=O)O)c1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 7/20 0.35
GRIN1 Q05586 4/20 0.34
GRIN2D O15399 2/20 0.34
GRIN3B O60391 2/20 0.34
GRIN2A Q12879 2/20 0.34
GRIN2B Q13224 2/20 0.34
GRIN2C Q14957 2/20 0.34
GRIN3A Q8TCU5 2/20 0.34
PTGDR Q13258 3/20 0.32
PTGDR2 Q9Y5Y4 3/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
PTGER2 P43116 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 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 SCHEMBL7547515 0.99 PPARD (0.34) PPARDGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL7551094 0.91 MTNR1A (0.34) PPARDGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL7550579 0.87 GRIN1 (0.36) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7555561 0.87 GRIN1 (0.35) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
Hydrochloric Acid SCHEMBL7655186 0.87 PTGDR2 (0.32) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
Hydrochloric Acid SCHEMBL7658632 0.87 PTGDR2 (0.32) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
Hydrochloric Acid SCHEMBL7554199 0.86 GRIN1 (0.34) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7548276 0.85 GPR17 (0.38) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7551416 0.83 GPR17 (0.34) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7549048 0.78 PTGDR (0.32) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B

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