SCHEMBL89519

SCHEMBL89519

COCCCN1C(=O)C(C)(C)Oc2ccc(N(C(=O)[C@H]3CNC[C@@H](C(=O)Nc4ccccc4OC)C3)C3CC3)cc21

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 14/20 0.55
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
POLB P06746 3/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL89428 0.93 REN (0.54) RENMEN1KMT2ATDP1POLB
SCHEMBL89865 0.92 REN (0.54) RENMEN1KMT2ATDP1
SCHEMBL89055 0.90 REN (0.53) RENMEN1KMT2ATDP1POLB
SCHEMBL89964 0.89 REN (0.55) RENMEN1KMT2APOLBALDH1A1
SCHEMBL89894 0.88 REN (0.52) RENMEN1KMT2APOLB
SCHEMBL8235431 0.88 REN (0.57) RENMEN1KMT2APOLBALDH1A1
SCHEMBL90645 0.88 REN (0.58) RENMEN1KMT2APOLBALDH1A1
SCHEMBL10283290 0.88 REN (0.58) RENMEN1KMT2APOLBALDH1A1
SCHEMBL90632 0.88 REN (0.57) RENMEN1KMT2APOLBALDH1A1
SCHEMBL89529 0.88 TDP1 (0.43) RENMEN1KMT2ATDP1POLB

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 1/4885MEN1 2336/4885KMT2A 3129/4885

“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.