SCHEMBL7506181

SCHEMBL7506181

CS(=O)(=O)c1ccc(-c2nc(Cc3ccccc3)oc2-c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 2/20 0.46
▸ RXRB P28702 2/20 0.46
▸ PTGS2 P35354 10/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ NR4A2 P43354 4/20 0.43
▸ FAAH O00519 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ PTGS1 P23219 1/20 0.42
▸ NR4A1 P22736 1/20 0.41
▸ NR4A3 Q92570 1/20 0.41
▸ CNR1 P21554 1/20 0.41

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
SCHEMBL7503574 0.92 PTGS2 (0.46) RXRARXRBPTGS2ALDH1A1LMNA
SCHEMBL7497030 0.92 RXRA (0.56) RXRARXRBPTGS2ALDH1A1LMNA
SCHEMBL7508948 0.91 PTGS2 (0.47) RXRARXRBPTGS2ALDH1A1LMNA
SCHEMBL7503849 0.91 PTGS2 (0.47) RXRARXRBPTGS2ALDH1A1LMNA
SCHEMBL7509654 0.90 RXRA (0.46) RXRARXRBPTGS2ALDH1A1LMNA
SCHEMBL7511828 0.89 NR4A2 (0.55) RXRARXRBPTGS2ALDH1A1LMNA
SCHEMBL7508671 0.88 PTGS2 (0.45) RXRARXRBPTGS2NR4A2PTGS1
SCHEMBL7503952 0.88 RXRA (0.44) RXRARXRBPTGS2ALDH1A1LMNA
SCHEMBL7511064 0.87 PTGS2 (0.57) RXRARXRBPTGS2ALDH1A1LMNA
SCHEMBL7511592 0.86 RXRA (0.46) RXRARXRBPTGS2ALDH1A1LMNA

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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