SCHEMBL89768

SCHEMBL89768

CCOCCN1C(=O)C(C)(C)Oc2ccc(N(C(=O)[C@H]3CNC[C@@H](C(=O)NC4(C5CCOCC5)CC4)C3)C3CC3)cc21

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
REN P00797 15/20 0.48
HPGD P15428 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KCNH2 Q12809 2/20 0.33
GAA P10253 2/20 0.32
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL89467 0.91 REN (0.52) RENHPGDALDH1A1KCNH2GAA
SCHEMBL8235599 0.91 REN (0.45) RENHPGDALDH1A1GAAPOLB
SCHEMBL90307 0.88 REN (0.50) RENALDH1A1KCNH2GAAPOLB
SCHEMBL90161 0.87 REN (0.37) RENHPGDALDH1A1GAAPOLB
SCHEMBL90206 0.87 REN (0.52) RENALDH1A1KCNH2GAAPOLB
SCHEMBL90618 0.85 REN (0.51) RENALDH1A1KCNH2GAAPOLB
SCHEMBL8236863 0.85 REN (0.52) RENALDH1A1KCNH2SMN1; SMN2
SCHEMBL90004 0.84 REN (0.61) RENALDH1A1KCNH2SMN1; SMN2
SCHEMBL90577 0.84 REN (0.65) RENKCNH2
SCHEMBL89404 0.83 REN (0.59) RENKCNH2

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
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
EP-2420491-A1 3 , 5-substitued piperidine compounds as renin inhibitors Novartis AG (CH) 2012-02-22 EP disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 US disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 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-20090192148-A1 Organic Compounds REN, ACE, AGTR1 REN 1/4885HPGD 723/4885ALDH1A1 38/4885

“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.