SCHEMBL2916468

SCHEMBL2916468

CCOc1cccc(C(C)(C)C)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.57
GABRA1 P14867 1/20 0.50
GABRB2 P47870 1/20 0.50
ALOX12 P18054 1/20 0.42
ALDH1A1 P00352 5/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 3/20 0.40
IGF1R P08069 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
BACE1 P56817 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NAMPT P43490 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 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
SCHEMBL4454748 0.89 CA2 (0.42) CA2GABRA1GABRB2ALDH1A1TDP1
SCHEMBL1264523 0.82 CA2 (0.53) CA2GABRA1GABRB2ALOX12ALDH1A1
SCHEMBL674008 0.82 ALDH1A1 (0.52) ALOX12ALDH1A1TDP1GLAL3MBTL1
SCHEMBL9825698 0.82 ALDH1A1 (0.52) ALOX12ALDH1A1TDP1GLAL3MBTL1
SCHEMBL12311837 0.81 CA2 (0.44) CA2GABRA1GABRB2ALOX12ALDH1A1
SCHEMBL6763906 0.80 CYP1A2 (0.53) ALDH1A1TDP1GLAL3MBTL1KDM4E
SCHEMBL9445437 0.80 CA2 (0.67) CA2GABRA1GABRB2ALOX12ALDH1A1
SCHEMBL6723921 0.80 RXRA (0.58) CA2GABRA1GABRB2TDP1L3MBTL1
SCHEMBL19532868 0.79 ALDH1A1 (0.42) CA2GABRA1GABRB2ALDH1A1TDP1
SCHEMBL295470 0.79 CA2 (0.64) CA2GABRA1GABRB2ALOX12ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108299263-A A kind of derivatives of probucol and the preparation method and application thereof 北京德默高科医药技术有限公司 2018-07-20 CN disclosed
EP-2110370-B1 Method of producing p-hydroxyphenylalkanols SUMITOMO CHEMICAL CO (JP) 2010-09-01 EP disclosed
EP-1348686-B1 Method of producing p-hydroxyphenylalkanols SUMITOMO CHEMICAL CO (JP) 2010-03-03 EP disclosed
EP-2110370-A1 Method of producing p-hydroxyphenylalkanols Sumitomo Chemical Company, Limited (JP) 2009-10-21 EP disclosed
US-6717020-B2 HIGH YIELD REACTION OF PHENOLS AND UNSATURATED ALCOHOLS IN PRESENCE OF SUCH AS TITANIUM TETRAETHOXIDE AND SODIUM METHOXIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-04-06 US disclosed
US-20030195379-A1 Method of producing p-Hydroxyphenylalkanols SUMITOMO CHEMICAL COMPANY, LIMITED 2003-10-16 US disclosed
EP-1348686-A1 Method of producing p-hydroxyphenylalkanols SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-10-01 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030195379-A1 Method of producing p-Hydroxyphenylalkanols ADH1C, NR1H3, ADH5 CA2 354/4885GABRA1 4187/4885GABRB2 4176/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.