SCHEMBL1037597

SCHEMBL1037597

CC(C)(C)[Si](C)(C)OCCc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 15/20 0.45
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
NMBR P28336 1/20 0.33
ENPP2 Q13822 1/20 0.32

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
SCHEMBL1039638 0.93 SIRT2 (0.43) SIRT2CYP11B1CYP11B2NMBR
SCHEMBL1039740 0.91 SIRT2 (0.43) SIRT2CYP11B1CYP11B2NMBR
SCHEMBL1097103 0.88 SIRT2 (0.42) SIRT2CYP11B1CYP11B2NMBRENPP2
SCHEMBL8543176 0.84 SIRT2 (0.40) SIRT2CYP11B1CYP11B2NMBRENPP2
SCHEMBL5792879 0.83 SIRT2 (0.47) SIRT2CYP11B1CYP11B2NMBRENPP2
SCHEMBL7939506 0.82 SIRT2 (0.40) SIRT2CYP11B1CYP11B2NMBRENPP2
SCHEMBL10815629 0.82 SIRT2 (0.46) SIRT2CYP11B1CYP11B2NMBRENPP2
SCHEMBL3821641 0.81 SIRT2 (0.46) SIRT2CYP11B1CYP11B2NMBRENPP2
SCHEMBL1037377 0.80 SIRT2 (0.33) SIRT2CYP11B1CYP11B2ENPP2
SCHEMBL4382643 0.78 SIRT2 (0.54) SIRT2CYP11B1CYP11B2ENPP2

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016109361-A2 3-FLUORO-BENZONITRILE INHIBITORS OF 11-BETA-HYDROXYLASE AUSPEX PHARMACEUTICALS, INC. (US) 2016-07-07 WO disclosed
US-9278969-B2 Organic compounds NOVARTIS AG (CH) 2016-03-08 US disclosed
US-20140357621-A1 Organic Compounds NOVARTIS AG (CH) 2014-12-04 US disclosed
EP-2256118-B1 Condensed imidazolo derivatives for the inhibition of aromatase and the treatment of aldosterone related diseases NOVARTIS AG (CH) 2014-10-29 EP disclosed
US-8835646-B2 Organic compounds NOVARTIS AG (CH) 2014-09-16 US disclosed
US-20130287789-A1 Organic Compounds NOVARTIS AG (CH) 2013-10-31 US disclosed
EP-1919916-B1 CONDENSED IMIDAZOLO DERIVATIVES FOR THE INHIBITION OF ALDOSTERONE SYNTHASE AND AROMATASE NOVARTIS AG (CH) 2013-04-03 EP disclosed
US-8314097-B2 Organic compounds NOVARTIS AG (CH) 2012-11-20 US disclosed
US-20120277215-A1 Organic Compounds RECORDATI AG (CH) 2012-11-01 US disclosed
US-8153674-B2 Organic compounds NOVARTIS AG (CH) 2012-04-10 US disclosed
EP-2256118-A1 Condensed imidazolo derivatives for the inhibition of aromatase Novartis AG (CH) 2010-12-01 EP disclosed
US-20100240641-A1 Aldosterone Synthase and/or 11B-hydroxylase Inhibitors PAPILLON JULIEN 2010-09-23 US disclosed
US-20090182007-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-07-16 US disclosed
EP-2029604-A2 ALDOSTERONE SYNTHASE AND/OR 11BETA-HYDROXYLASE INHIBITORS Novartis AG (CH) 2009-03-04 EP disclosed
EP-2001866-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2008-12-17 EP disclosed
EP-1919916-A1 CONDENSED IMIDAZOLO DERIVATIVES FOR THE INHIBITION OF ALDOSTERONE SYNTHASE AND AROMATASE Novartis AG (CH) 2008-05-14 EP disclosed
WO-2007139992-A2 ALDOSTERONE SYNTHASE AND/OR 11β-HYDROXYLASE INHIBITORS NOVARTIS AG (CH) 2007-12-06 WO disclosed
WO-2007117982-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2007-10-18 WO disclosed
US-20070049616-A1 Organic compounds RECORDATI AG (CH) 2007-03-01 US disclosed
WO-2007024945-A1 CONDENSED IMIDAZOLO DERIVATIVES FOR THE INHIBITION OF ALDOSTERONE SYNTHASE AND AROMATASE NOVARTIS AG (CH) 2007-03-01 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 (6 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-20070049616-A1 Organic compounds CYP19A1, CYP17A1, HSD17B11 SIRT2 2715/4885CYP11B1 5/4885CYP11B2 14/4885
US-20100240641-A1 Aldosterone Synthase and/or 11B-hydroxylase Inhibitors HSD11B1, HSD11B2, CYP11B1 SIRT2 2223/4885CYP11B1 3/4885CYP11B2 4/4885
US-20130287789-A1 Organic Compounds CYP19A1, CYP17A1, HSD17B11 SIRT2 2715/4885CYP11B1 5/4885CYP11B2 14/4885
US-20120277215-A1 Organic Compounds CYP19A1, CYP17A1, HSD17B11 SIRT2 2715/4885CYP11B1 5/4885CYP11B2 14/4885
US-20140357621-A1 Organic Compounds CYP19A1, CYP17A1, HSD17B11 SIRT2 2715/4885CYP11B1 5/4885CYP11B2 14/4885
US-20090182007-A1 ORGANIC COMPOUNDS REN, CYP17A1, HSD17B1 SIRT2 3959/4885CYP11B1 12/4885CYP11B2 28/4885

“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.