SCHEMBL9768498

SCHEMBL9768498

O=C(O)C(CCCCCc1ccccc1)c1cccnc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 11/20 0.54
PPARG P37231 1/20 0.51
PPARA Q07869 1/20 0.51
EPHX2 P34913 1/20 0.47
TRPA1 O75762 1/20 0.47
FAAH O00519 1/20 0.46

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
SCHEMBL28368180 0.83 TBXAS1 (0.53) TBXAS1PPARGPPARA
SCHEMBL19463451 0.81 TBXAS1 (0.50) TBXAS1PPARGPPARAEPHX2
SCHEMBL19463449 0.81 TBXAS1 (0.50) TBXAS1PPARGPPARAEPHX2
SCHEMBL9520336 0.81 TBXAS1 (0.53) TBXAS1
SCHEMBL8461393 0.80 TBXAS1 (0.49) TBXAS1PPARGPPARAEPHX2
SCHEMBL10869186 0.79 GRIK1 (0.53) TBXAS1PPARGPPARAEPHX2
Hydrochloric Acid SCHEMBL28880680 0.79 P4HTM (0.58) TBXAS1PPARGPPARAEPHX2
SCHEMBL20213798 0.78 TBXAS1 (0.49) TBXAS1EPHX2
SCHEMBL30479399 0.78 TBXAS1 (0.53) TBXAS1PPARGPPARAEPHX2
SCHEMBL744044 0.77 TBXAS1 (0.48) TBXAS1PPARGPPARAEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0449764-A2 A method of reducing serum uric acid and/or increasing renal uric acid clearance with thromboxane synthetase inhibitor and/or thromboxane receptor antagonist CIBA-GEIGY AG (CH) 1991-10-02 EP disclosed
US-5021448-A Method of reducing serum uric acid and/or increasing renal uric acid clearance with thromboxane synthetase inhibitor inhibitor and/or thromboxane receptor antagonist CIBA-GEIGY CORPORATION (US) 1991-06-04 US disclosed