SCHEMBL8169305

SCHEMBL8169305

CCc1cccc(-c2c(Cl)cccc2[C@@](O)(CCCNC(=O)OC)[C@@H]2CCCN(C(=O)c3ccc(CN)cc3)C2)c1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.76
CYP3A4 P08684 8/20 0.76

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
SCHEMBL8166194 1.00 REN (0.76) RENCYP3A4
SCHEMBL3116153 1.00 REN (0.76) RENCYP3A4
SCHEMBL13249791 0.95 REN (0.69) RENCYP3A4
SCHEMBL3117832 0.95 REN (0.69) RENCYP3A4
SCHEMBL13250002 0.95 REN (0.75) RENCYP3A4
SCHEMBL8156802 0.95 REN (0.75) RENCYP3A4
SCHEMBL3109723 0.94 REN (0.76) RENCYP3A4
SCHEMBL3115653 0.94 REN (0.76) RENCYP3A4
SCHEMBL8155095 0.94 REN (0.76) RENCYP3A4
SCHEMBL8156835 0.94 REN (0.67) RENCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100179109-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2010-07-15 US disclosed
US-20100179109-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2010-07-15 US disclosed
US-20090275581-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20090275581-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20090264428-A1 Renin Inhibitors VITAE PHARMACEUTICALS, INC. 2009-10-22 US disclosed
US-20090264428-A1 Renin Inhibitors VITAE PHARMACEUTICALS, INC. 2009-10-22 US disclosed
WO-2008124575-A1 RENIN INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 WO disclosed
WO-2007117482-A2 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2007-10-18 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-20100179109-A1 RENIN INHIBITORS REN, ACE, AGTR1 REN 1/4885CYP3A4 2462/4885
US-20090275581-A1 RENIN INHIBITORS REN, ACE, SERPINB1 REN 1/4885CYP3A4 1612/4885
US-20090264428-A1 Renin Inhibitors REN, ACE, SERPINB1 REN 1/4885CYP3A4 1583/4885

“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.