SCHEMBL4660262

SCHEMBL4660262

Cc1cc(NC(=O)c2ccc(C(=O)O)cc2)nn1Cc1cc(Cl)cc2cc(C(C)C)oc12

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 19/20 0.67
PTGER3 P43115 1/20 0.67
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL4159251 0.91 PTGER1 (0.62) PTGER1PTGER3MAPTHTTSMN1; SMN2
SCHEMBL4165076 0.91 PTGER1 (0.60) PTGER1PTGER3MAPTHTTSMN1; SMN2
SCHEMBL4157337 0.91 PTGER1 (0.59) PTGER1PTGER3MAPTHTTSMN1; SMN2
SCHEMBL4166007 0.89 PTGER1 (0.74) PTGER1PTGER3MAPTHTTSMN1; SMN2
SCHEMBL13873971 0.88 PTGER1 (0.63) PTGER1PTGER3MAPTHTTSMN1; SMN2
SCHEMBL4168648 0.88 PTGER1 (0.64) PTGER1PTGER3MAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL4164930 0.88 PTGER1 (0.73) PTGER1PTGER3MAPTHTTSMN1; SMN2
SCHEMBL4159664 0.87 PTGER1 (0.58) PTGER1PTGER3MAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL4166801 0.86 PTGER1 (0.57) PTGER1PTGER3MAPTHTTSMN1; SMN2
SCHEMBL4162156 0.81 PTGER1 (1.00) PTGER1PTGER3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2001872-A1 BENZOFURAN COMPOUNDS AS EP1 RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2008-12-17 EP disclosed
WO-2007113289-A1 BENZOFURAN COMPOUNDS AS EP1 RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2007-10-11 WO disclosed