SCHEMBL6532391

SCHEMBL6532391

O=C(O)Cc1ccc2c(c1)CC(CNS(=O)(=O)c1cccc(Cl)c1)C2

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 13/20 0.66
HSD11B1 P28845 4/20 0.48

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
SCHEMBL8731670 0.89 TBXA2R (0.82) TBXA2R
SCHEMBL5673556 0.88 TBXA2R (0.85) TBXA2R
SCHEMBL8733726 0.86 TBXA2R (0.67) TBXA2R
SCHEMBL8730089 0.84 TBXA2R (0.65) TBXA2R
SCHEMBL8734677 0.83 TBXA2R (0.84) TBXA2R
SCHEMBL8733779 0.81 TBXA2R (0.70) TBXA2R
SCHEMBL8734661 0.81 TBXA2R (0.70) TBXA2R
SCHEMBL8734691 0.81 TBXA2R (0.70) TBXA2R
SCHEMBL8730048 0.81 TBXA2R (0.70) TBXA2R
SCHEMBL8730165 0.81 TBXA2R (0.70) TBXA2R

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-1494666-A1 ORALLY DELIVERABLE PHARMACEUTICAL COMPOSITION COMPRISING AN ACTIVE COMPOUND HAVING AN AMINOSULFONYL GROUP (COX-2 INHIBITOR), A POLYETHYLENE GLYCOL AND A FREE-RADICAL SCAVENGING ANTIOXIDANT Pharmacia Corporation (US) 2005-01-12 EP disclosed
WO-2002102376-A1 ORALLY DELIVERABLE PHARMACEUTICAL COMPOSITION COMPRISING AN ACTIVE COMPOUND HAVING AN AMINOSULFONYL GROUP (cox-2 INHIBITOR), A POLYETHYLENE GLYCOL AND A FREE-RADICAL SCAVENGING ANTIOXIDANT PHARMACIA CORPORATION (US) 2002-12-27 WO disclosed