SCHEMBL2818525

SCHEMBL2818525

CC1(C)C(=O)c2ccc(F)cc2[C@@H]1n1cncc1CO

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 4/20 0.48
IDO1 P14902 3/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
TDO2 P48775 1/20 0.33
CACNA1B Q00975 2/20 0.31
KCNH2 Q12809 1/20 0.31
CYP11B1 P15538 1/20 0.30
HTR6 P50406 2/20 0.30
HTR1A P08908 1/20 0.30
HTR7 P34969 1/20 0.30

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
SCHEMBL2818527 1.00 CYP11B2 (0.48) CYP11B2IDO1CA1CA2CA7
SCHEMBL2818681 0.83 CYP11B2 (0.52) CYP11B2IDO1TDO2
SCHEMBL2818872 0.83 CYP11B2 (0.52) CYP11B2IDO1TDO2
SCHEMBL2819320 0.83 CYP11B2 (0.52) CYP11B2IDO1TDO2
SCHEMBL2820667 0.79 CYP11B2 (0.53) CYP11B2IDO1KCNH2CYP11B1HTR6
SCHEMBL843195 0.73 CYP11B2 (0.69) CYP11B2IDO1TDO2
SCHEMBL2821046 0.72 CYP11B2 (0.62) CYP11B2IDO1TDO2KCNH2
SCHEMBL2822331 0.72 CYP11B2 (0.62) CYP11B2IDO1TDO2KCNH2
SCHEMBL2817749 0.72 CYP11B2 (0.71) CYP11B2IDO1TDO2KCNH2
SCHEMBL2817744 0.72 CYP11B2 (0.71) CYP11B2IDO1TDO2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436035-B2 Organic compounds NOVARTIS AG (CH) 2013-05-07 US disclosed
EP-2213668-A2 Imidazoles as aldosterone synthase inhibitors Novartis AG (CH) 2010-08-04 EP disclosed
US-20100048562-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-25 US disclosed
CN-101605777-A Imidazoles as aldosterone synthase inhibitors NOVARTIS AG (CH) 2009-12-16 CN disclosed
EP-2094680-A2 IMIDAZOLES AS ALDOSTERONE SYNTHASE INHIBITORS Novartis AG (CH) 2009-09-02 EP disclosed
WO-2008076336-A2 IMIDAZOLES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2008-06-26 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-20100048562-A1 ORGANIC COMPOUNDS CYP11B1, HSD11B1, CYP17A1 CYP11B2 6/4885IDO1 1361/4885CA1 1469/4885

“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.