SCHEMBL4497163

SCHEMBL4497163

CCCCCCOCCCOC(C)C

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
MEN1 O00255 1/20 0.50
THRB P10828 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
DNM1 Q05193 1/20 0.47
USP2 O75604 1/20 0.44
LPAR1 Q92633 4/20 0.43
LPAR3 Q9UBY5 4/20 0.43
LPAR2 Q9HBW0 1/20 0.43
SPHK1 Q9NYA1 1/20 0.43
CES2 O00748 1/20 0.42
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL18510364 1.00 HTT (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL18510368 1.00 HTT (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL18510370 1.00 HTT (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL26198723 1.00 HTT (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL18510353 1.00 HTT (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL27959768 0.98 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL4492276 0.95 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL24754956 0.91 HTT (0.56) HTTMEN1THRBKMT2AMAPT
SCHEMBL18510366 0.91 HTT (0.56) HTTMEN1THRBKMT2AMAPT
SCHEMBL18510372 0.91 HTT (0.56) HTTMEN1THRBKMT2AMAPT

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 HTT 1255/4885MEN1 534/4885THRB 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 HTT 1183/4885MEN1 245/4885THRB 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.