SCHEMBL90353

SCHEMBL90353

CCOC[C@@H](CC(C)C)NC(=O)[C@H]1C[C@@H](C(=O)N(c2ccc3c(c2)N(CCOC(C)C)C(=O)C(C)(C)O3)C2CC2)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
REN P00797 17/20 0.53
KCNH2 Q12809 5/20 0.38
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
USP2 O75604 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
SCHEMBL89799 0.96 REN (0.55) RENKCNH2MEN1ALDH1A1KMT2A
SCHEMBL90657 0.96 REN (0.55) RENKCNH2MEN1ALDH1A1KMT2A
SCHEMBL90711 0.95 REN (0.58) RENKCNH2MEN1ALDH1A1KMT2A
SCHEMBL8229650 0.95 REN (0.58) RENKCNH2MEN1ALDH1A1KMT2A
SCHEMBL89683 0.94 REN (0.53) RENKCNH2MEN1ALDH1A1KMT2A
SCHEMBL90098 0.93 REN (0.54) RENKCNH2MEN1ALDH1A1KMT2A
SCHEMBL90212 0.93 REN (0.54) RENKCNH2MEN1ALDH1A1KMT2A
SCHEMBL89141 0.93 REN (0.51) RENKCNH2MEN1ALDH1A1KMT2A
SCHEMBL89824 0.93 REN (0.63) RENKCNH2MEN1ALDH1A1KMT2A
SCHEMBL89914 0.93 REN (0.63) RENKCNH2MEN1ALDH1A1KMT2A

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 1/4885KCNH2 415/4885MEN1 2336/4885

“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.