SCHEMBL7555324

SCHEMBL7555324

O=C(O)CC1CCc2cc(Cl)cc3[nH]c(C(=O)O)c1c23

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.45
GRIN2D O15399 2/20 0.45
GRIN3B O60391 2/20 0.45
GRIN2A Q12879 2/20 0.45
GRIN2B Q13224 2/20 0.45
GRIN2C Q14957 2/20 0.45
GRIN3A Q8TCU5 2/20 0.45
GPR17 Q13304 3/20 0.43
FBP1 P09467 1/20 0.43
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAPK1 P28482 1/20 0.37
BLM P54132 1/20 0.37
PMP22 Q01453 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL7648683 1.00 GRIN1 (0.45) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7550297 0.88 GRIN1 (0.41) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7549570 0.84 GRIN1 (0.52) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7555561 0.77 GRIN1 (0.35) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7550579 0.77 GRIN1 (0.36) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
Hydrochloric Acid SCHEMBL7554199 0.77 GRIN1 (0.34) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7548276 0.76 GPR17 (0.38) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7549065 0.76 PPARD (0.35) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL7657650 0.75 MTNR1A (0.44) MEN1LMNACYP1A2MAPK1KMT2A
Hydrochloric Acid SCHEMBL7547515 0.75 PPARD (0.34) 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