SCHEMBL3463864

SCHEMBL3463864

COc1cc(C#N)ccc1Cn1cncc1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 6/20 0.47
FNTB P49356 6/20 0.47
PGGT1B P53609 6/20 0.47
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44

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
SCHEMBL13563966 0.88 CYP11B1 (0.42) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL3628808 0.82 CYP11B1 (0.60) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL1097299 0.78 CYP19A1 (0.42) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL1040117 0.77 CYP11B1 (0.50) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL17894305 0.77 FNTA (0.42) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL14562263 0.77 FNTA (0.44) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL13563963 0.75 CYP11B1 (0.43) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL14562317 0.75 CYP11B1 (0.43) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL13563965 0.75 CYP11B1 (0.45) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL3465788 0.74 CYP11B2 (0.41) FNTAFNTBPGGT1BCYP11B1CYP11B2

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 4 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
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 FNTA 352/4885FNTB 245/4885PGGT1B 203/4885

“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.