SCHEMBL7501033

SCHEMBL7501033

CS(=O)(=O)c1ccc(-c2oc(Cc3ccccc3)nc2-c2ccc(F)c(F)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 18/20 0.51
PTGS1 P23219 5/20 0.47
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
NR4A2 P43354 1/20 0.40

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
SCHEMBL7506375 0.96 PTGS2 (0.51) PTGS2PTGS1ALDH1A1LMNAMAPT
SCHEMBL7503762 0.92 PTGS2 (0.52) PTGS2PTGS1ALDH1A1LMNAMAPT
SCHEMBL7501386 0.92 PTGS2 (0.52) PTGS2PTGS1MAPTNR4A2
SCHEMBL7508644 0.89 CA1 (0.47) PTGS2PTGS1MAPT
SCHEMBL7504879 0.89 PTGS2 (0.55) PTGS2PTGS1MAPT
SCHEMBL7506306 0.88 PTGS2 (0.53) PTGS2PTGS1NR4A2
SCHEMBL7505504 0.88 PTGS2 (0.52) PTGS2PTGS1NR4A2
SCHEMBL7505741 0.88 PTGS2 (0.62) PTGS2PTGS1
SCHEMBL7502011 0.87 PTGS2 (0.66) PTGS2PTGS1LMNANR4A2
SCHEMBL7504432 0.87 PTGS2 (0.66) PTGS2PTGS1LMNANR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0699192-B1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION SEARLE & CO (US) 2002-07-24 EP claimed
EP-0699192-A1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-03-06 EP claimed
WO-1994027980-A1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1994-12-08 WO claimed
EP-0699192-B1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION SEARLE & CO (US) 2002-07-24 EP disclosed
US-6090834-A ANALGESICS; RHEUMATIC DISORDERS; SKIN DISORDERS; GASTROINTESTINAL DISORDERS G.D. SEARLE & CO. (US) 2000-07-18 US disclosed
EP-0825989-A1 SUBSTITUTED OXAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1998-03-04 EP disclosed
US-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed
WO-1996036617-A1 SUBSTITUTED OXAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-11-21 WO disclosed