SCHEMBL7507004

SCHEMBL7507004

COc1c(Cl)cccc1-c1oc(Cc2ccccc2)nc1-c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 12/20 0.45
▸ NR4A2 P43354 4/20 0.43
▸ RXRA P19793 3/20 0.42
▸ RXRB P28702 2/20 0.42
▸ RXRG P48443 1/20 0.42
▸ NR4A1 P22736 1/20 0.41
▸ NR4A3 Q92570 1/20 0.41
▸ RORC P51449 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PTGS1 P23219 1/20 0.38

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
SCHEMBL7505180 0.92 PTGS2 (0.43) PTGS2NR4A2RXRARXRBRORC
SCHEMBL7505716 0.91 NR4A2 (0.43) PTGS2NR4A2RXRARXRBRXRG
SCHEMBL7511828 0.89 NR4A2 (0.55) PTGS2NR4A2RXRARXRBRXRG
SCHEMBL7501928 0.89 PTGS2 (0.46) PTGS2RXRAPTGS1
SCHEMBL7510288 0.87 PTGS2 (0.48) PTGS2NR4A2RXRARXRBRXRG
SCHEMBL7500980 0.86 PTGS2 (0.47) PTGS2RXRARXRBRXRGALDH1A1
SCHEMBL7505563 0.85 RXRA (0.56) PTGS2RXRAPTGS1
SCHEMBL7511138 0.85 PTGS2 (0.49) PTGS2NR4A2RXRARXRBRXRG
SCHEMBL7512154 0.85 PTGS2 (0.43) PTGS2RXRAALDH1A1LMNAMAPT
SCHEMBL7500607 0.84 PTGS2 (0.47) PTGS2RXRARXRBRXRGALDH1A1

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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