SCHEMBL89593

SCHEMBL89593

CCOC1(CNC(=O)[C@@H]2CNC[C@H](C(=O)N(c3ccc4c(c3)N(CCCOC)C(=O)C(C)(C)O4)C3CC3)C2)CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
REN P00797 16/20 0.55
KCNH2 Q12809 4/20 0.35
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL90099 0.95 REN (0.54) RENKCNH2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL89116 0.92 REN (0.54) RENKCNH2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL90127 0.89 REN (0.54) RENKCNH2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL89897 0.89 REN (0.44) RENALDH1A1SMN1; SMN2KMT2APOLB
SCHEMBL89840 0.87 REN (0.55) RENALDH1A1SMN1; SMN2KMT2APOLB
SCHEMBL89222 0.87 REN (0.63) RENKCNH2ALDH1A1SMN1; SMN2POLB
SCHEMBL90669 0.87 REN (0.57) RENKCNH2ALDH1A1SMN1; SMN2POLB
SCHEMBL89766 0.87 REN (0.62) RENKCNH2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL89763 0.87 REN (0.52) RENKCNH2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL90156 0.86 REN (0.53) RENKCNH2ALDH1A1SMN1; SMN2KMT2A

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 6 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
WO-2007077005-A1 3 , 5-SUBSTITΓUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS NOVARTIS AG (CH) 2007-07-12 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-20090192148-A1 Organic Compounds REN, ACE, AGTR1 REN 1/4885KCNH2 415/4885ALDH1A1 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.