SCHEMBL1352863

SCHEMBL1352863

CCCC=C(C)C(C)=CCCC

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.37
BACE1 P56817 1/20 0.33
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32

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
SCHEMBL1352862 1.00 TSHR (0.37) TSHRALDH1A1BACE1GRIK1GRIK2
SCHEMBL2535782 0.82
SCHEMBL21462991 0.82 TSHR (0.30) TSHRALDH1A1
SCHEMBL21462990 0.82 TSHR (0.30) TSHRALDH1A1
SCHEMBL2535783 0.82
SCHEMBL6752709 0.82
SCHEMBL6752710 0.82
SCHEMBL20018403 0.80
SCHEMBL6722403 0.80
SCHEMBL6722404 0.80

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
CN-102224146-B Method for manufacturing sulfolene compound and method for manufacturing sulfolane compound SUMITOMO SEIKA CHEMICALS 2015-04-22 CN disclosed
EP-2368888-B1 METHOD FOR MANUFACTURING SULFOLENE COMPOUND AND METHOD FOR MANUFACTURING SULFOLANE COMPOUND SUMITOMO SEIKA CHEMICALS (JP) 2014-03-26 EP disclosed
US-8436193-B2 Method for manufacturing sulfolene compound and method for manufacturing sulfolane compound SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2013-05-07 US disclosed
US-20110288307-A1 METHOD FOR MANUFACTURING SULFOLENE COMPOUND AND METHOD FOR MANUFACTURING SULFOLANE COMPOUND SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2011-11-24 US disclosed
CN-102224146-A Method for manufacturing sulfolene compound and method for manufacturing sulfolane compound SUMITOMO SEIKA CHEMICALS 2011-10-19 CN disclosed
EP-2368888-A1 METHOD FOR MANUFACTURING SULFOLENE COMPOUND AND METHOD FOR MANUFACTURING SULFOLANE COMPOUND Sumitomo Seika Chemicals CO. LTD. (JP) 2011-09-28 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-20110288307-A1 METHOD FOR MANUFACTURING SULFOLENE COMPOUND AND METHOD FOR MANUFACTURING SULFOLANE COMPOUND SULT1A1, STS, SULT2A1 TSHR 1420/4885ALDH1A1 43/4885BACE1 1341/4885

“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.