SCHEMBL7284155

SCHEMBL7284155

O=Cc1ccc(OCC(=O)O)cc1OCC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.63
PTPN7 P35236 1/20 0.51
TSHR P16473 2/20 0.50
ALOX15 P16050 2/20 0.47
HSD17B10 Q99714 1/20 0.47
MCL1 Q07820 1/20 0.47
LMNA P02545 2/20 0.46
ALDH1A1 P00352 3/20 0.46
PDE2A O00408 1/20 0.45
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45
P2RY12 Q9H244 1/20 0.45
MAPT P10636 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
NTSR1 P30989 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL7840891 0.89 ALDH1A1 (0.63) PTGDR2HSD17B10LMNAALDH1A1MAPT
SCHEMBL3292757 0.89 ALDH1A1 (0.63) PTGDR2PTPN7TSHRMCL1LMNA
SCHEMBL29707984 0.89 ALDH1A1 (0.63) PTGDR2HSD17B10LMNAALDH1A1MAPT
SCHEMBL29669441 0.89 ALDH1A1 (0.63) PTGDR2PTPN7TSHRMCL1LMNA
SCHEMBL2558336 0.88 PTGDR2 (0.54) PTGDR2TSHRLMNAALDH1A1MAPT
SCHEMBL7285781 0.87 PTGDR2 (0.69) PTGDR2PTPN7TSHRALOX15HSD17B10
SCHEMBL5302743 0.83 PTGDR2 (0.63) PTGDR2TSHRL3MBTL1SMN1; SMN2
SCHEMBL7293656 0.83 TRIM24 (0.57) PTGDR2PTPN7TSHRALOX15HSD17B10
SCHEMBL23804143 0.82 MCL1 (0.58) PTGDR2PTPN7TSHRALOX15HSD17B10
SCHEMBL4241015 0.82 PTGDR2 (0.61) PTGDR2TSHRLMNAL3MBTL1CYP2C19

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
US-4760064-A Cardiotonic agent OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-07-26 US disclosed
EP-0187322-A1 Carbostyril compounds, compositions containing same and processes for preparing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-07-16 EP disclosed