SCHEMBL7510702

SCHEMBL7510702

Cc1c(Cl)cccc1-c1nc(Cc2ccccc2)oc1-c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 16/20 0.48
▸ RXRA P19793 2/20 0.44
▸ RXRB P28702 2/20 0.44
▸ NR4A2 P43354 1/20 0.44
▸ HSD11B1 P28845 1/20 0.42
▸ PTGS1 P23219 4/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ RXRG P48443 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
SCHEMBL7510288 0.92 PTGS2 (0.48) PTGS2RXRARXRBNR4A2HSD11B1
SCHEMBL7511507 0.91 CA1 (0.44) PTGS2RXRARXRBNR4A2PTGS1
SCHEMBL7501268 0.88 PTGS2 (0.48) PTGS2RXRARXRBPTGS1RXRG
SCHEMBL7503989 0.87 PTGS2 (0.49) PTGS2RXRARXRBNR4A2PTGS1
SCHEMBL7505180 0.87 PTGS2 (0.43) PTGS2RXRARXRBNR4A2HSD11B1
SCHEMBL7508189 0.86 RXRA (0.54) PTGS2RXRARXRBNR4A2PTGS1
SCHEMBL7504508 0.86 PTGS2 (0.48) PTGS2RXRAPTGS1ALDH1A1LMNA
SCHEMBL7511828 0.85 NR4A2 (0.55) PTGS2RXRARXRBNR4A2HSD11B1
SCHEMBL7507741 0.85 PTGS2 (0.47) PTGS2RXRARXRBNR4A2PTGS1
SCHEMBL7503574 0.84 PTGS2 (0.46) PTGS2RXRARXRBNR4A2PTGS1

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 7 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 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
EP-0699192-A1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-03-06 — — EP disclosed
WO-1994027980-A1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1994-12-08 — — WO disclosed
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