SCHEMBL1880732

SCHEMBL1880732

CCOC(=O)/C=C/OC(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.52
MAPT P10636 5/20 0.43
NPSR1 Q6W5P4 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
ALDH1A1 P00352 3/20 0.39
TTR P02766 1/20 0.38
DPP4 P27487 1/20 0.38
ATM Q13315 1/20 0.38
LMNA P02545 3/20 0.36
MDM2 Q00987 2/20 0.36
MDM4 O15151 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34

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
SCHEMBL1880733 1.00 HCAR2 (0.52) HCAR2MAPTNPSR1CA12CA1
SCHEMBL11099236 0.84 HCAR2 (0.48) HCAR2MAPTNPSR1CA12CA1
SCHEMBL11785680 0.84 HCAR2 (0.48) HCAR2MAPTNPSR1CA12CA1
SCHEMBL11110695 0.84 HCAR2 (0.48) HCAR2MAPTNPSR1CA12CA1
SCHEMBL1874934 0.84 HCAR2 (0.55) HCAR2MAPTNPSR1ALDH1A1ATM
SCHEMBL1874932 0.84 HCAR2 (0.55) HCAR2MAPTNPSR1ALDH1A1ATM
SCHEMBL11108361 0.82 HCAR2 (0.47) HCAR2MAPTNPSR1CA12CA1
Hydrochloric Acid SCHEMBL8439411 0.82 HCAR2 (0.47) HCAR2MAPTNPSR1CA12CA1
SCHEMBL27447896 0.82 HCAR2 (0.47) HCAR2MAPTNPSR1CA12CA1
SCHEMBL1875094 0.82 TSHR (0.53) HCAR2MAPTALDH1A1ATMLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1666440-B1 METHOD FOR PRODUCING AROMATIC UNSATURATED COMPOUND SUMITOMO CHEMICAL CO (JP) 2014-01-22 EP disclosed
US-7939674-B2 Process for producing an aromatic unsaturated compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-10 US disclosed
US-7700642-B2 Process for producing an aromatic unsaturated compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-20 US disclosed
US-20090111999-A1 PROCESS FOR PRODUCING AN AROMATIC UNSATURATED COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-30 US disclosed
US-20080221337-A1 Process for Producing an Aromatic Unsaturated Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-11 US disclosed
EP-1666440-A1 METHOD FOR PRODUCING AROMATIC UNSATURATED COMPOUND Sumitomo Chemical Company, Limited (JP) 2006-06-07 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 (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-20080221337-A1 Process for Producing an Aromatic Unsaturated Compound AHR, AR, ARSA HCAR2 122/4885MAPT 4307/4885NPSR1 1306/4885
US-20090111999-A1 PROCESS FOR PRODUCING AN AROMATIC UNSATURATED COMPOUND AHR, AR, ARSA HCAR2 122/4885MAPT 4307/4885NPSR1 1306/4885

“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.