SCHEMBL7499819

SCHEMBL7499819

NS(=O)(=O)c1ccc(-c2nc(CCc3ccccc3)oc2-c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
NR4A2 P43354 10/20 0.54
RXRA P19793 7/20 0.53
RXRB P28702 7/20 0.53
RXRG P48443 4/20 0.53
PTGS2 P35354 4/20 0.53
NR4A1 P22736 3/20 0.53
NR4A3 Q92570 3/20 0.53
PTGS1 P23219 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ABCC4 O15439 1/20 0.53
C5 P01031 1/20 0.53
LMNA P02545 1/20 0.53
CHRM2 P08172 1/20 0.53
CYP3A4 P08684 1/20 0.53
CHRM1 P11229 1/20 0.53
DRD2 P14416 1/20 0.53
HPGD P15428 1/20 0.53
TSHR P16473 1/20 0.53

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
SCHEMBL7498736 1.00 CA1 (0.60) CA1CA2NR4A2RXRARXRB
SCHEMBL7501412 0.93 PTGS2 (0.60) CA1CA2NR4A2RXRARXRB
SCHEMBL7505591 0.93 NR4A2 (0.55) CA1CA2NR4A2RXRARXRB
SCHEMBL7503374 0.93 NR4A2 (0.55) CA1CA2NR4A2RXRARXRB
SCHEMBL8552924 0.90 RXRA (0.65) CA1CA2NR4A2RXRARXRB
SCHEMBL6025964 0.89 NR4A2 (0.55) CA1CA2NR4A2RXRARXRB
SCHEMBL7503191 0.89 CA1 (0.55) CA1CA2NR4A2RXRARXRB
SCHEMBL7501428 0.89 CA1 (0.55) CA1CA2NR4A2RXRARXRB
SCHEMBL8550570 0.88 NR4A2 (0.57) CA1CA2NR4A2RXRARXRB
SCHEMBL7501479 0.88 NR4A2 (0.54) CA1CA2NR4A2RXRARXRB

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 9 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
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