SCHEMBL663105

SCHEMBL663105

Cc1cc(Cl)c(OCCOc2ccc(CI)cc2)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
REN P00797 17/20 0.49
MAPT P10636 2/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TDP1 Q9NUW8 1/20 0.41
PPARG P37231 1/20 0.40
CYP3A4 P08684 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
SCHEMBL10289213 0.86 REN (0.50) RENMAPTHPGDMAPK1L3MBTL1
SCHEMBL7602449 0.85 MAPT (0.51) RENMAPTHPGDMAPK1L3MBTL1
SCHEMBL2543486 0.84 REN (0.49) RENMAPTHPGDMAPK1L3MBTL1
SCHEMBL2547093 0.84 REN (0.52) RENMAPTHPGDMAPK1L3MBTL1
SCHEMBL8165437 0.84 MAPT (0.48) RENMAPTHPGDMAPK1L3MBTL1
SCHEMBL8080432 0.83 PPARG (0.45) RENMAPTHPGDMAPK1L3MBTL1
SCHEMBL1751411 0.82 MAPT (0.49) RENMAPTHPGDMAPK1L3MBTL1
SCHEMBL12601506 0.81 REN (0.48) RENMAPTHPGDMAPK1L3MBTL1
SCHEMBL5795265 0.80 MAPT (0.58) RENMAPTHPGDMAPK1L3MBTL1
SCHEMBL3925202 0.79 MAPT (0.47) RENMAPTHPGDMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2190811-B1 RENIN INHIBITORS MERCK CANADA INC (CA) 2013-08-07 EP disclosed
US-8334308-B2 Renin inhibitors MERCK SHARP & DOHME CORP. (US) 2012-12-18 US disclosed
US-8334308-B2 Renin inhibitors MERCK SHARP & DOHME CORP. (US) 2012-12-18 US disclosed
US-8334308-B2 Renin inhibitors MERCK SHARP & DOHME CORP. (US) 2012-12-18 US disclosed
US-20120046293-A1 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2012-02-23 US disclosed
US-8063105-B2 Renin inhibitors MERCK CANADA INC. (CA) 2011-11-22 US disclosed
US-20110263658-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2011-10-27 US disclosed
US-20110263658-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2011-10-27 US disclosed
US-20110263658-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2011-10-27 US disclosed
EP-2190811-A1 RENIN INHIBITORS Merck Frosst Canada Ltd. (CA) 2010-06-02 EP disclosed
US-20090281103-A1 Renin Inhibitors MERCK CANADA INC. (CA) 2009-11-12 US disclosed
WO-2009023964-A1 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2009-02-26 WO disclosed
EP-1910272-A1 RENIN INHIBITORS Merck Frosst Canada Ltd. (CA) 2008-04-16 EP disclosed
WO-2007009250-A1 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-01-25 WO 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-20120046293-A1 RENIN INHIBITORS REN, ACE, AGTR1 REN 1/4885MAPT 3436/4885HPGD 559/4885
US-20110263658-A1 RENIN INHIBITORS REN, ACE, AGTR1 REN 1/4885MAPT 3838/4885HPGD 1816/4885
US-20090281103-A1 Renin Inhibitors REN, ACE, AGT REN 1/4885MAPT 3785/4885HPGD 523/4885

“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.