SCHEMBL11301403

SCHEMBL11301403

O=C(O)C1=CC(=O)C(c2ccccc2)(c2ccccc2)O1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 19/20 0.65
HCAR3 P49019 11/20 0.65
CYP1A2 P05177 1/20 0.65

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
Acifran SCHEMBL188221 0.79 HCAR2 (1.00) HCAR2HCAR3CYP1A2
Acifran SCHEMBL5055334 0.79 HCAR2 (1.00) HCAR2HCAR3CYP1A2
SCHEMBL11292321 0.76 HCAR2 (0.62) HCAR2HCAR3CYP1A2
SCHEMBL3100365 0.75 HCAR2 (0.56) HCAR2HCAR3CYP1A2
SCHEMBL3107779 0.75 HCAR2 (1.00) HCAR2HCAR3CYP1A2
SCHEMBL11413968 0.73 HCAR2 (0.78) HCAR2HCAR3CYP1A2
Acifran SCHEMBL1876828 0.72 HCAR2 (0.83) HCAR2HCAR3CYP1A2
SCHEMBL3108555 0.71 HCAR2 (1.00) HCAR2HCAR3CYP1A2
SCHEMBL3108561 0.71 HCAR2 (0.76) HCAR2HCAR3CYP1A2
Acifran SCHEMBL11406401 0.70 HCAR2 (0.78) HCAR2HCAR3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0006305-B1 DERIVATIVES OF 4,5-DIHYDRO-4-OXOFURAN-2-CARBOXYLIC ACID, ESPECIALLY FOR USE AS HYPOLIPIDEMIC AGENTS, PROCESSES FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS COMPRISING THEM, TETRAHYDROPYRAN-2,3,5-TRIONES USEFUL IN THE PREPARATION OF THE SAID DERIVATIVES AND A PROCESS FOR PREPARING THESE TETRAHYDROPYRAN-2,3,5-TRIONES AMERICAN HOME PRODUCTS CORPORATION (US) 1982-08-11 EP disclosed
US-4244958-A Hypolipidemic derivatives of 4,5-dihydro-4-oxofuran-2-carboxylic acid AMERICAN HOME PRODUCTS CORPORATION (US) 1981-01-13 US disclosed
WO-1980000025-A1 DERIVATIVES OF 4,5-DIHYDRO-4-OXOFURAN-2-CARBOXYLIC ACID,PREPARATIONS AND USE THEREOF AND TETRAHYDROPYRAN-2,3,5-TRIONE INTERMEDIATES AMERICAN HOME PROD (US) 1980-01-10 WO disclosed
EP-0006305-A1 Derivatives of 4,5-dihydro-4-oxofuran-2-carboxylic acid, especially for use as hypolipidemic agents, processes for their preparation, pharmaceutical compositions comprising them, tetrahydropyran-2,3,5-triones useful in the preparation of the said derivatives and a process for preparing these tetrahydropyran-2,3,5-triones AMERICAN HOME PRODUCTS CORPORATION (US) 1980-01-09 EP disclosed
US-4169202-A Process for preparing 4,5-dihydro-4-oxofuran-2-carboxylic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1979-09-25 US disclosed