SCHEMBL5596568

SCHEMBL5596568

Cc1ccc(O)c(P(c2cccc(Cl)c2)c2cc(C)ccc2O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.42
ALOX15 P16050 4/20 0.39
HSD17B10 Q99714 4/20 0.39
ALDH1A1 P00352 4/20 0.39
ALOX5 P09917 1/20 0.39
TRPA1 O75762 1/20 0.38
HPGD P15428 5/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
MAPT P10636 3/20 0.38
TP53 P04637 2/20 0.38
LMNA P02545 2/20 0.38
ALOX12 P18054 2/20 0.38
GAA P10253 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HTT P42858 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL5596542 0.81 ALOX15 (0.45) ESR2ALOX15HSD17B10ALDH1A1TRPA1
SCHEMBL5596301 0.80 ALDH1A1 (0.44) ESR2ALOX15HSD17B10ALDH1A1ALOX5
SCHEMBL5596286 0.80 TSHR (0.42) ESR2ALOX15HSD17B10ALDH1A1ALOX5
SCHEMBL5596528 0.79 ESR2 (0.38) ESR2ALDH1A1ALOX5MAPTLMNA
SCHEMBL7189644 0.78 ALOX15 (0.45) ESR2ALOX15HSD17B10ALDH1A1TRPA1
SCHEMBL6438829 0.76 TRPA1 (0.56) ALOX15HSD17B10ALDH1A1TRPA1HPGD
SCHEMBL5595981 0.75 ALDH1A1 (0.42) ESR2HSD17B10ALDH1A1ALOX5TRPA1
SCHEMBL197486 0.72 ALDH1A1 (0.46) ALDH1A1ALOX5MEN1KMT2AMAPT
SCHEMBL29851249 0.72 ALDH1A1 (0.46) ALDH1A1ALOX5MEN1KMT2AMAPT
SCHEMBL5596412 0.71 CFTR (0.34) ALDH1A1ALOX5HPGDMAPTTP53

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
US-7279537-B2 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-09 US disclosed
US-20060229195-A1 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-12 US disclosed
EP-1557423-A1 TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS Sumitomo Chemical Company, Limited (JP) 2005-07-27 EP disclosed