SCHEMBL1782098

SCHEMBL1782098

C=CC(=O)N(COCCO)COCCO

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.43
ZDHHC20 Q5W0Z9 2/20 0.39
MAPK1 P28482 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 4/20 0.34
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.31
CYP3A4 P08684 1/20 0.30

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
SCHEMBL11148760 0.92 TSHR (0.41) TSHRZDHHC20MAPK1MEN1KMT2A
SCHEMBL8619511 0.86 ZDHHC20 (0.48) TSHRZDHHC20MAPK1MEN1KMT2A
SCHEMBL2120387 0.82 ZDHHC20 (0.48) TSHRZDHHC20ALDH1A1TP53HIF1A
SCHEMBL2121555 0.79 ZDHHC20 (0.56) TSHRZDHHC20MEN1KMT2AALDH1A1
SCHEMBL11557201 0.78 ZDHHC20 (0.37) TSHRZDHHC20ALDH1A1TP53HIF1A
SCHEMBL4805541 0.77 ZDHHC20 (0.44) TSHRZDHHC20ALDH1A1TP53HIF1A
SCHEMBL2120418 0.77 ZDHHC20 (0.62) TSHRZDHHC20MEN1KMT2AZDHHC2
SCHEMBL2118440 0.77 ZDHHC20 (0.43) TSHRZDHHC20ALDH1A1TP53HIF1A
SCHEMBL29236330 0.76 ZDHHC20 (0.54) TSHRZDHHC20MEN1KMT2AALDH1A1
SCHEMBL7910911 0.73 ZDHHC20 (0.41) ZDHHC20ZDHHC2

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
EP-2260830-B1 FOAMABLE SKIN WASHING AGENT SHISEIDO CO LTD (JP) 2018-02-21 EP disclosed
US-8946137-B2 Foamable skin washing agent SHISEIDO COMPANY, LTD. (JP) 2015-02-03 US disclosed
US-20130178406-A1 Foamable Skin Washing Agent SHISEIDO COMPANY, LTD. (JP) 2013-07-11 US disclosed
US-20110118164-A1 Foamable Skin Washing Agent SHISEIDO COMPANY, LTD. (JP) 2011-05-19 US disclosed
EP-2260830-A1 FOAMABLE SKIN WASHING AGENT Shiseido Company, Ltd. (JP) 2010-12-15 EP disclosed
US-20090010867-A1 Skin Cleansing Composition NALCO COMPANY 2009-01-08 US disclosed
EP-1847172-A1 SKIN CLEANSER COMPOSITION Shiseido Company, Limited (JP) 2007-10-24 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 (3 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-20090010867-A1 Skin Cleansing Composition CUTA, DSG1, DSC1 TSHR 4257/4885ZDHHC20 1083/4885MAPK1 2242/4885
US-20110118164-A1 Foamable Skin Washing Agent DIMT1, TPMT, MTAP TSHR 4756/4885ZDHHC20 688/4885MAPK1 2100/4885
US-20130178406-A1 Foamable Skin Washing Agent DIMT1, TPMT, MTAP TSHR 4756/4885ZDHHC20 688/4885MAPK1 2100/4885

“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.