SCHEMBL1496800

SCHEMBL1496800

OCC(O)COc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
MAPK1 P28482 1/20 0.56
LMNA P02545 2/20 0.53
MAPT P10636 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
ADRB2 P07550 1/20 0.51
ADRB1 P08588 1/20 0.51
CYP2D6 P10635 1/20 0.51
ADRB3 P13945 1/20 0.51
KDM4E B2RXH2 2/20 0.50
CYP1A2 P05177 2/20 0.50
AR P10275 1/20 0.50
LTA4H P09960 1/20 0.50
AGTR1 P30556 1/20 0.50

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
SCHEMBL8994531 1.00 TSHR (0.56) TSHRMAPK1LMNAMAPTHTT
SCHEMBL4619478 0.92 TSHR (0.62) TSHRMAPK1LMNAMAPTHTT
SCHEMBL6480727 0.92 TSHR (0.62) TSHRMAPK1LMNAMAPTHTT
SCHEMBL117951 0.92 TSHR (0.62) TSHRMAPK1LMNAMAPTHTT
SCHEMBL5010945 0.92 AR (0.56) TSHRMAPK1LMNAMAPTHTT
SCHEMBL14173946 0.91 TSHR (0.48) TSHRMAPK1LMNAMAPTHTT
SCHEMBL14173742 0.89 TSHR (0.47) TSHRMAPK1LMNAMAPTHTT
SCHEMBL14173867 0.87 SMN1; SMN2 (0.45) TSHRMAPK1LMNAMAPTHTT
Bicarbonate SCHEMBL27926288 0.87 TSHR (0.57) TSHRMAPK1LMNAMAPTHTT
SCHEMBL14173983 0.87 MAPT (0.46) TSHRMAPK1LMNAMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7082201-A None JP disclosed
US-7906667-B2 Method for producing optically active alcohol compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-15 US disclosed
US-20100234629-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 US disclosed
US-7728179-B2 Method for producing optically active alcohol compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-01 US disclosed
EP-1380342-B1 COMPLEX CATALYST, PROCESS FOR PRODUCING THE COMPLEX CATALYST, AND PROCESS FOR PRODUCING ALCOHOL DERIVATIVE WITH THE COMPLEX CATALYST SUMITOMO CHEMICAL CO (JP) 2009-07-01 EP disclosed
US-20090012330-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-08 US disclosed
EP-1982972-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-10-22 EP disclosed
EP-1982973-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-10-22 EP disclosed
US-6995110-B2 Complex catalyst, process for producing the complex catalyst, and process for producing alcohol derivative with the complex catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-02-07 US disclosed
US-20040077487-A1 Complex catalyst, process for producing the complex catalyst, and process for producing alchohol derivative with the complex catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-04-22 US disclosed
EP-1380342-A1 COMPLEX CATALYST, PROCESS FOR PRODUCING THE COMPLEX CATALYST, AND PROCESS FOR PRODUCING ALCOHOL DERIVATIVE WITH THE COMPLEX CATALYST SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2004-01-14 EP disclosed
EP-0501912-B1 Methyldioxolane CIBA GEIGY AG (CH) 1996-08-14 EP disclosed
US-5478958-A Stereoselective acetalization catalyst CIBA-GEIGY CORPORATION (US) 1995-12-26 US disclosed
JP-H0782201-A PREPARATION OF PHENOXYPHENOXYALKYL DERIVATIVE CIBA GEIGY AG 1995-03-28 JP disclosed
EP-0643053-A1 Process for the manufacture of phenoxyphenoxyalkyl derivatives CIBA-GEIGY AG (CH) 1995-03-15 EP disclosed
US-5384416-A Stereospecific insecticides CIBA-GEIGY CORPORATION (US) 1995-01-24 US disclosed
US-5280041-A Such as 4-((4-phenoxyphenoxy)methyl)dioxolan CIBA-GEIGY CORPORATION (US) 1994-01-18 US disclosed
EP-0501912-A1 Methyldioxolane CIBA-GEIGY AG (CH) 1992-09-02 EP disclosed
US-4100296-A PESTICIDE, PLANT GROWTH RECULATOR CIBA-GEIGY CORPORATION (US) 1978-07-11 US disclosed
US-4097581-A PESTICIDES, PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1978-06-27 US 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 (2 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-20090012330-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL COMPOUND ADH1A, ADH1C, ADH5 TSHR 1213/4885MAPK1 1367/4885LMNA 3411/4885
US-20100234629-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL COMPOUND ADH1A, ADH1C, ADH5 TSHR 1138/4885MAPK1 885/4885LMNA 3091/4885

“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.