SCHEMBL4495197

SCHEMBL4495197

CCCCOCCOCCCCCCCCO

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.74
KMT2A Q03164 2/20 0.74
THRB P10828 1/20 0.74
HTT P42858 1/20 0.74
MAPT P10636 1/20 0.74
TSHR P16473 3/20 0.68
LMNA P02545 2/20 0.57
ALDH1A1 P00352 2/20 0.57
HSD17B10 Q99714 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.52
USP2 O75604 1/20 0.47
CYP3A4 P08684 1/20 0.46
ACHE P22303 6/20 0.46
CES2 O00748 1/20 0.45

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
SCHEMBL13500010 1.00 MEN1 (0.74) MEN1KMT2ATHRBHTTMAPT
SCHEMBL5434893 0.97 TSHR (0.71) MEN1KMT2ATHRBHTTMAPT
SCHEMBL11081210 0.97 TSHR (0.71) MEN1KMT2ATHRBHTTMAPT
SCHEMBL29098933 0.97 TSHR (0.71) MEN1KMT2ATHRBHTTMAPT
SCHEMBL9083720 0.97 TSHR (0.71) MEN1KMT2ATHRBHTTMAPT
SCHEMBL822812 0.97 TSHR (0.71) MEN1KMT2ATHRBHTTMAPT
SCHEMBL4392282 0.97 TSHR (0.71) MEN1KMT2ATHRBHTTMAPT
SCHEMBL874676 0.97 TSHR (0.71) MEN1KMT2ATHRBHTTMAPT
SCHEMBL2532324 0.97 TSHR (0.71) MEN1KMT2ATHRBHTTMAPT
SCHEMBL8813644 0.95 MEN1 (0.82) MEN1KMT2ATHRBHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1655291-B1 COMPOUNDS HAVING THROMBOPOIETIN RECEPTOR AGONISM SHIONOGI & CO (JP) 2016-08-03 EP disclosed
US-20090318513-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN RECEPTOR AGONISM SHIONOGI & CO., LTD. 2009-12-24 US disclosed
US-7601746-B2 Compounds exhibiting thrombopoietin receptor agonism SHIONOGI & CO., LTD. (JP) 2009-10-13 US disclosed
US-20070043087-A1 Such as 3-{2,6-difluoro-4-[4,5-dihydro-6-(3,3-dimethylbutyl)naphtho[1,2-d]thiazol-2-ylcabamoyl)phenyl]-2-methylacrylic acid EDDINGPHARM (HONG KONG) COMPANY LIMITED (CN) 2007-02-22 US disclosed
EP-1655291-A1 COMPOUNDS HAVING THROMBOPOIETIN RECEPTOR AGONISM SHIONOGI & CO., LTD. (JP) 2006-05-10 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-20090318513-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN RECEPTOR AGONISM MPL, TEK, GHRHR MEN1 534/4885KMT2A 3732/4885THRB 92/4885
US-20070043087-A1 Such as 3-{2,6-difluoro-4-[4,5-dihydro-6-(3,3-dimethylbutyl)naphtho[1,2-d]thiazol-2-ylcabamoyl)phenyl]-2-methylacrylic acid DHFR, NAT1, ACR MEN1 245/4885KMT2A 1294/4885THRB 2080/4885

“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.