SCHEMBL8226702

SCHEMBL8226702

COc1nccc(CN(C(=O)C2=C(c3ccc(CCCOc4c(F)ccc(F)c4Cl)cc3)C(C)(C)CN(C(=O)OCCOCCON(O)O)C2)C2CC2)c1C

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.56
CYP3A4 P08684 3/20 0.46
CTSD P07339 1/20 0.42
CTSE P14091 1/20 0.42

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
SCHEMBL8231426 0.96 REN (0.57) RENCYP3A4CTSDCTSE
SCHEMBL8231168 0.94 REN (0.56) RENCYP3A4CTSDCTSE
SCHEMBL13232965 0.92 REN (0.55) RENCYP3A4CTSDCTSE
SCHEMBL8226658 0.91 REN (0.51) RENCYP3A4CTSDCTSE
SCHEMBL8226581 0.90 REN (0.57) RENCYP3A4CTSDCTSE
SCHEMBL13232973 0.89 REN (0.55) RENCYP3A4CTSDCTSE
SCHEMBL8234098 0.88 REN (0.67) RENCYP3A4CTSDCTSE
SCHEMBL8231943 0.88 REN (0.51) RENCYP3A4CTSDCTSE
SCHEMBL8225945 0.88 REN (0.56) RENCYP3A4CTSDCTSE
SCHEMBL13232975 0.86 REN (0.55) RENCYP3A4CTSDCTSE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100166839-A1 NON PEPTIDIC RENIN INHIBITORS NITRODERIVATIVES NICOX S.A (FR) 2010-07-01 US disclosed
WO-2007104652-A2 NON-PEPTIDIC RENIN INHIBITORS NITRODERIVATIVES NICOX S.A. (FR) 2007-09-20 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 (1 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-20100166839-A1 NON PEPTIDIC RENIN INHIBITORS NITRODERIVATIVES REN, AGTR1, GLS REN 1/4885CYP3A4 388/4885CTSD 1004/4885

“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.