SCHEMBL3465882

SCHEMBL3465882

CCC1(c2ccc(C#N)cc2OC)C(=O)N(Cc2ccc(Cl)cc2)Cc2cncn21

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 12/20 0.75
CYP19A1 P11511 1/20 0.41
FNTA P49354 3/20 0.38
FNTB P49356 3/20 0.38
PGGT1B P53609 2/20 0.38
CYP11B1 P15538 2/20 0.37
SCN9A Q15858 2/20 0.36
PDE5A O76074 1/20 0.36
PDE6C P51160 1/20 0.36
CMA1 P23946 1/20 0.34

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
SCHEMBL3465189 0.83 CYP11B2 (0.60) CYP11B2CYP19A1FNTAFNTBCYP11B1
SCHEMBL3465186 0.83 CYP11B2 (0.60) CYP11B2CYP19A1FNTAFNTBCYP11B1
SCHEMBL3465210 0.81 CYP11B2 (0.58) CYP11B2
SCHEMBL3464269 0.81 CYP11B2 (0.58) CYP11B2
SCHEMBL3465213 0.81 CYP11B2 (0.58) CYP11B2
SCHEMBL3464267 0.81 CYP11B2 (0.58) CYP11B2
SCHEMBL3465432 0.77 CYP11B2 (0.55) CYP11B2CYP19A1FNTAFNTBPGGT1B
SCHEMBL3465435 0.77 CYP11B2 (0.55) CYP11B2CYP19A1FNTAFNTBPGGT1B
SCHEMBL3464675 0.76 CYP11B2 (0.70) CYP11B2CYP19A1FNTAFNTBCYP11B1
SCHEMBL3464672 0.76 CYP11B2 (0.70) CYP11B2CYP19A1FNTAFNTBCYP11B1

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-20100240641-A1 Aldosterone Synthase and/or 11B-hydroxylase Inhibitors PAPILLON JULIEN 2010-09-23 US disclosed
US-20100240641-A1 Aldosterone Synthase and/or 11B-hydroxylase Inhibitors PAPILLON JULIEN 2010-09-23 US disclosed
US-20100240641-A1 Aldosterone Synthase and/or 11B-hydroxylase Inhibitors PAPILLON JULIEN 2010-09-23 US disclosed
EP-2029604-A2 ALDOSTERONE SYNTHASE AND/OR 11BETA-HYDROXYLASE INHIBITORS Novartis AG (CH) 2009-03-04 EP disclosed
WO-2007139992-A2 ALDOSTERONE SYNTHASE AND/OR 11β-HYDROXYLASE INHIBITORS NOVARTIS AG (CH) 2007-12-06 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-20100240641-A1 Aldosterone Synthase and/or 11B-hydroxylase Inhibitors HSD11B1, HSD11B2, CYP11B1 CYP11B2 4/4885CYP19A1 42/4885FNTA 352/4885

“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.