SCHEMBL7547774

SCHEMBL7547774

COC(=O)c1[nH]c2cc(Cl)cc(CCC=CC(=O)OC(C)(C)C)c2c1Br

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.32
GPR17 Q13304 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ATM Q13315 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GRIN1 Q05586 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
SCHEMBL7547773 1.00 FBP1 (0.32) FBP1GPR17KDM4EALDH1A1HPGD
SCHEMBL7550281 0.79 ULK1 (0.35) FBP1GRIN1
SCHEMBL7550279 0.79 ULK1 (0.35) FBP1GRIN1
SCHEMBL7653241 0.76 ALOX15 (0.36) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7653239 0.76 ALOX15 (0.36) KDM4EALDH1A1HPGDHSD17B10
Ethoxycarbonyl Group SCHEMBL27355886 0.73 GPR17 (0.31) GPR17
SCHEMBL27343729 0.70 GPR17 (0.32) GPR17
Ethoxycarbonyl Group SCHEMBL27343730 0.67 P2RX7 (0.31)
SCHEMBL7658321 0.66 ALOX15 (0.41)
SCHEMBL7550064 0.66 MAPK14 (0.33) KDM4EALDH1A1HPGDATMHSD17B10

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