SCHEMBL7507741

SCHEMBL7507741

Cc1ccc(-c2nc(Cc3ccccc3)oc2-c2ccc(S(C)(=O)=O)cc2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 14/20 0.47
▸ PTGS1 P23219 5/20 0.42
▸ RXRA P19793 3/20 0.41
▸ RXRB P28702 3/20 0.41
▸ NR4A2 P43354 1/20 0.41
▸ MAPK14 Q16539 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 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
SCHEMBL7508948 0.92 PTGS2 (0.47) PTGS2PTGS1RXRARXRBNR4A2
SCHEMBL7500284 0.91 CA1 (0.43) PTGS2PTGS1RXRARXRBNR4A2
SCHEMBL7503574 0.91 PTGS2 (0.46) PTGS2PTGS1RXRARXRBNR4A2
SCHEMBL7504876 0.90 PTGS2 (0.49) PTGS2PTGS1RXRARXRBNR4A2
SCHEMBL7506614 0.88 PTGS2 (0.47) PTGS2PTGS1RXRARXRB
SCHEMBL7504416 0.88 PTGS2 (0.49) PTGS2PTGS1RXRARXRBNR4A2
SCHEMBL7507571 0.87 PTGS2 (0.45) PTGS2PTGS1RXRARXRBNR4A2
SCHEMBL7513407 0.86 PTGS2 (0.47) PTGS2PTGS1RXRARXRBALDH1A1
SCHEMBL7502679 0.85 PTGS2 (0.62) PTGS2PTGS1RXRARXRBNR4A2
SCHEMBL7509684 0.85 PTGS2 (0.62) PTGS2PTGS1RXRARXRBNR4A2

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 6 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
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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