SCHEMBL7964160

SCHEMBL7964160

Cc1c(CC2CCCC=C2c2nc(-c3ccccc3)c(-c3ccccc3)o2)cccc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 6/20 0.54
PTGER4 P35408 5/20 0.54
PTGER1 P34995 1/20 0.54
PTGER3 P43115 1/20 0.51
FABP4 P15090 2/20 0.33
FABP3 P05413 1/20 0.33
DRD2 P14416 5/20 0.33
DRD3 P35462 5/20 0.33
DRD4 P21917 3/20 0.33
DRD1 P21728 2/20 0.33
DRD5 P21918 2/20 0.33
HTR1D P28221 2/20 0.32
PTGS2 P35354 1/20 0.32
MAPK13 O15264 1/20 0.30
MAPK12 P53778 1/20 0.30
MAPK11 Q15759 1/20 0.30
MAPK14 Q16539 1/20 0.30

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
SCHEMBL7960041 0.92 PTGER4 (0.56) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7486687 0.87 PTGIR (0.57) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL8546529 0.86 PTGIR (0.61) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7959959 0.85 PTGIR (0.59) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7964274 0.85 PTGIR (0.54) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7499969 0.84 PTGIR (0.61) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7960526 0.84 PTGIR (0.60) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL8546524 0.84 PTGIR (0.58) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7486495 0.83 PTGIR (0.61) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7949627 0.83 PTGIR (0.69) PTGIRPTGER4PTGER1PTGER3FABP4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6245790-B1 ANTIINFLAMMATORY AGENTS; GASTROINTESTINAL DISORDERS; SKN DISORDERS; BONE DISORDERS; MUSCLE RELAXANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-06-12 US disclosed
EP-0989975-A1 OXAZOLE COMPOUNDS USEFUL AS PGE2 AGONISTS AND ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 EP disclosed
WO-2000016760-A2 NEW USE OF PROSTAGLANDIN E2 ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-03-30 WO disclosed
WO-1998055468-A1 OXAZOLE COMPOUNDS USEFUL AS PGE2 AGONISTS AND ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-10 WO disclosed