SCHEMBL14225083

SCHEMBL14225083

CC(O)c1ccncc1-c1ccc(C#N)c(F)c1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 18/20 0.58
CYP11B2 P19099 18/20 0.58
SLC22A12 Q96S37 1/20 0.55
RPS6KA3 P51812 1/20 0.51

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
SCHEMBL6920203 0.86 CYP11B2 (0.44) CYP11B1CYP11B2SLC22A12RPS6KA3
SCHEMBL14225099 0.85 SLC22A12 (0.55) CYP11B1CYP11B2SLC22A12RPS6KA3
SCHEMBL1769849 0.82 SLC22A12 (0.56) CYP11B1CYP11B2SLC22A12
SCHEMBL6920046 0.82 SLC22A12 (0.44) CYP11B1CYP11B2SLC22A12RPS6KA3
SCHEMBL14225109 0.79 RPS6KA3 (0.52) CYP11B1CYP11B2SLC22A12RPS6KA3
SCHEMBL14225113 0.79 CYP11B1 (0.44) CYP11B1CYP11B2SLC22A12RPS6KA3
SCHEMBL6921694 0.78 SLC22A12 (0.50) CYP11B1CYP11B2SLC22A12RPS6KA3
SCHEMBL6921683 0.77 RPS6KA3 (0.51) CYP11B1CYP11B2SLC22A12RPS6KA3
SCHEMBL6919942 0.77 CYP11B2 (0.66) CYP11B1CYP11B2SLC22A12RPS6KA3
SCHEMBL1769864 0.76 SLC22A12 (0.54) CYP11B1CYP11B2SLC22A12RPS6KA3

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2501678-B1 ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2015-09-23 EP claimed
EP-2993169-A1 ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS Novartis AG (CH) 2016-03-09 EP disclosed
US-8519134-B2 Aryl-pyridine derivatives as aldosterone synthase inhibitors NOVARTIS AG (CH) 2013-08-27 US disclosed
US-8519134-B2 Aryl-pyridine derivatives as aldosterone synthase inhibitors NOVARTIS AG (CH) 2013-08-27 US disclosed
US-20120316195-A1 ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2012-12-13 US disclosed
US-20120316195-A1 ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2012-12-13 US disclosed
CN-102712589-A Aryl-pyridine derivatives as aldosterone synthase inhibitors NOVARTIS AG 2012-10-03 CN 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-20120316195-A1 ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS CYP21A2, CYP11B1, CYP17A1 CYP11B1 2/4885CYP11B2 4/4885SLC22A12 2415/4885

“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.