SCHEMBL9831485

SCHEMBL9831485

O=C1NC(=O)C(Cc2ccc3oc(C(=O)c4ccccc4)nc3c2)S1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.52
MPC2 O95563 1/20 0.45
CYP2C8 P10632 1/20 0.45
CYP2C9 P11712 1/20 0.45
ALDH1A1 P00352 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 1/20 0.43
PTPN1 P18031 2/20 0.42
FFAR1 O14842 5/20 0.42
AKT1 P31749 1/20 0.41
PIK3CA P42336 1/20 0.41
PPARA Q07869 2/20 0.41
MAOA P21397 2/20 0.41
CISD1 Q9NZ45 2/20 0.41
MAOB P27338 1/20 0.39

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
SCHEMBL10514710 0.83 PPARG (0.51) PPARGMPC2CYP2C8CYP2C9ALDH1A1
SCHEMBL9558560 0.83 PPARG (0.49) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL9830603 0.79 FFAR1 (0.46) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL377496 0.77 FFAR1 (0.43) PPARGMPC2CYP2C8CYP2C9ALDH1A1
SCHEMBL290976 0.77 UTRN (0.48) PPARGALDH1A1NPSR1MAPTFFAR1
SCHEMBL11640335 0.77 GAA (0.58) ALDH1A1
SCHEMBL9830775 0.76 PPARG (0.43) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL9832774 0.75 ALDH1A1 (0.45) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL9832866 0.75 FFAR1 (0.57) PPARGMPC2CYP2C8CYP2C9FFAR1
SCHEMBL9832232 0.75 FFAR1 (0.41) PPARGALDH1A1NPSR1MAPTPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1026322-C Process for preparing benzodumb azole derivatives TANABE SEIYAKU CO (JP) 1994-10-26 CN disclosed
EP-0283035-B1 BENZOXAZOLE DERIVATIVES AND PREPARATION THEREOF TANABE SEIYAKU CO., LTD. (JP) 1991-11-06 EP disclosed
US-4948900-A INTERMEDIATES FOR DIABETES THERAPEUTIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1990-08-14 US disclosed
US-4897393-A ANTIDIABETIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1990-01-30 US disclosed
CN-88101542-A Benzoxazole derivatives and process for preparing them 1988-10-05 CN disclosed
EP-0283035-A1 Benzoxazole derivatives and preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1988-09-21 EP disclosed