SCHEMBL9006747

SCHEMBL9006747

CCCCCCCCCCc1cccc(OP(O)O)c1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.48
ALOX5 P09917 1/20 0.47
PTGS2 P35354 1/20 0.47
PPARG P37231 2/20 0.46
LIPG Q9Y5X9 1/20 0.44
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
BID P55957 3/20 0.42
MCL1 Q07820 3/20 0.42
BCL2L1 Q07817 2/20 0.42
BAK1 Q16611 2/20 0.42
KAT8 Q9H7Z6 2/20 0.42
EP300 Q09472 1/20 0.42
KAT2A Q92830 1/20 0.42
KAT2B Q92831 1/20 0.42
KAT5 Q92993 1/20 0.42
SAE1 Q9UBE0 1/20 0.42
CYSLTR2 Q9NS75 5/20 0.40
CYSLTR1 Q9Y271 5/20 0.40
DHFR P00374 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
SCHEMBL4601779 0.92 PPARA (0.48) PPARAALOX5PTGS2PPARGLIPG
SCHEMBL11871510 0.89 GCGR (0.41) PPARAALOX5PTGS2PPARGLIPG
Biphenyl SCHEMBL10941344 0.87 THRA (0.53) PPARAALOX5PTGS2PPARGLIPG
SCHEMBL29005750 0.84 PPARA (0.50) PPARAALOX5PTGS2PPARGLIPG
SCHEMBL27866899 0.84 ALOX5 (0.39) PPARAALOX5PTGS2PPARGLIPG
SCHEMBL247534 0.84 THRA (0.58) PPARAALOX5PTGS2PPARGLIPG
SCHEMBL11674760 0.84 THRA (0.58) PPARAALOX5PTGS2PPARGLIPG
SCHEMBL4445684 0.84 THRA (0.58) PPARAALOX5PTGS2PPARGLIPG
SCHEMBL4443988 0.84 THRA (0.58) PPARAALOX5PTGS2PPARGLIPG
SCHEMBL7196282 0.84 THRA (0.58) PPARAALOX5PTGS2PPARGLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0189899-B2 Synthetic resin composition having reduced corrosion-causing tendency and coloration KYOWA CHEM IND CO LTD (JP) 1996-10-16 EP disclosed
US-4675356-A HYDROTALCITE SOLID SOLUTION KYOWA CHEMICAL INDUSTRY CO., LTD. (JP) 1987-06-23 US disclosed
EP-0189899-A2 Synthetic resin composition having reduced corrosion-causing tendency and coloration Kyowa Chemical Industry Co., Ltd. (JP) 1986-08-06 EP disclosed