SCHEMBL89244

SCHEMBL89244

COc1cc(CN(C(=O)[C@@H]2C[C@H](C(=O)NC(CO)CC(C)C)CN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
REN P00797 4/20 0.43
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.36
STS P08842 2/20 0.35
EPHX2 P34913 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
BCL9 O00512 2/20 0.34
CTNNB1 P35222 2/20 0.34
CETP P11597 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
GPR119 Q8TDV5 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
SCHEMBL89092 0.94 REN (0.46) RENALDH1A1LMNA
SCHEMBL89207 0.94 REN (0.46) RENALDH1A1LMNA
SCHEMBL89204 0.94 REN (0.44) RENALDH1A1LMNA
SCHEMBL8234922 0.92 REN (0.45) RENALDH1A1LMNA
SCHEMBL90335 0.92 REN (0.43) RENALDH1A1LMNATSHRSTS
SCHEMBL8235667 0.91 REN (0.41) RENALDH1A1LMNATSHRSTS
SCHEMBL89614 0.91 REN (0.44) RENALDH1A1LMNATSHREPHX2
SCHEMBL89266 0.91 REN (0.42) RENALDH1A1LMNATSHRSTS
SCHEMBL89818 0.90 REN (0.41) RENALDH1A1LMNATSHR
SCHEMBL8239216 0.90 REN (0.39) RENALDH1A1LMNATSHRSTS

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 1/4885ALDH1A1 38/4885LMNA 1594/4885

“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.