SCHEMBL3087263

SCHEMBL3087263

COCCCN1C(=O)CSc2ccc(COC3CC(c4ccc(OCCCOCc5ccccc5OC)cc4)CCN3C(=O)OC(C)(C)C)cc21

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.41
CYP3A4 P08684 3/20 0.41
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL3413258 0.86 REN (0.46) RENCYP3A4ALDH1A1
SCHEMBL3072934 0.82 REN (0.42) RENCYP3A4
SCHEMBL3417409 0.80 REN (0.48) RENCYP3A4ALDH1A1
SCHEMBL3072786 0.79 REN (0.42) REN
SCHEMBL3078900 0.78 REN (0.66) RENCYP3A4
SCHEMBL3263399 0.77 REN (0.38) RENCYP3A4
SCHEMBL3080457 0.75 REN (0.53) RENCYP3A4
SCHEMBL3419766 0.74 REN (0.54) RENCYP3A4
SCHEMBL3076936 0.73 REN (0.48) RENCYP3A4
SCHEMBL3259290 0.72 REN (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7790715-B2 Organic compounds NOVARTIS AG (CH) 2010-09-07 US disclosed
US-20070010511-A1 Organic compounds NOVARTIS PHARMA AG (CH) 2007-01-11 US 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-20070010511-A1 Organic compounds REN, ACE, ACE2 REN 1/4885CYP3A4 29/4885ALDH1A1 142/4885

“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.