SCHEMBL89614

SCHEMBL89614

COCCNC(=O)c1cc(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 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
REN P00797 13/20 0.44
ALDH1A1 P00352 4/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.34
KCNH2 Q12809 4/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
EPHX2 P34913 1/20 0.32
TSHR P16473 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL89244 0.91 REN (0.43) RENALDH1A1LMNAMEN1KMT2A
SCHEMBL89092 0.90 REN (0.46) RENALDH1A1LMNAKCNH2
SCHEMBL89204 0.90 REN (0.44) RENALDH1A1LMNAKCNH2
SCHEMBL89207 0.90 REN (0.46) RENALDH1A1LMNAKCNH2
SCHEMBL8234922 0.89 REN (0.45) RENALDH1A1LMNAKCNH2
SCHEMBL90335 0.89 REN (0.43) RENALDH1A1LMNAKCNH2MEN1
SCHEMBL89266 0.88 REN (0.42) RENALDH1A1LMNAKCNH2MEN1
SCHEMBL89818 0.86 REN (0.41) RENALDH1A1LMNAKCNH2TSHR
SCHEMBL89737 0.85 REN (0.44) RENALDH1A1LMNAKCNH2
SCHEMBL8235667 0.85 REN (0.41) RENALDH1A1LMNAKCNH2MEN1

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 1/4885ALDH1A1 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.