SCHEMBL2818690

SCHEMBL2818690

CC1(C)Oc2ccccc2C1n1cncc1CO

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.47
ABCC9 O60706 3/20 0.37
IDO1 P14902 5/20 0.36
TDO2 P48775 2/20 0.36
KCNE1 P15382 1/20 0.36
KCNQ1 P51787 1/20 0.36
KCNH2 Q12809 4/20 0.33
HTR2B P41595 1/20 0.32
HTT P42858 1/20 0.31

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
SCHEMBL2818687 1.00 CYP11B2 (0.47) CYP11B2ABCC9IDO1TDO2KCNE1
SCHEMBL1096591 0.84 CYP11B2 (0.64) CYP11B2IDO1TDO2
SCHEMBL1096593 0.84 CYP11B2 (0.64) CYP11B2IDO1TDO2
SCHEMBL2819619 0.80 CYP11B2 (0.40) CYP11B2ABCC9IDO1KCNE1KCNQ1
SCHEMBL2819617 0.80 CYP11B2 (0.40) CYP11B2ABCC9IDO1KCNE1KCNQ1
SCHEMBL2819933 0.80 CYP11B2 (0.40) CYP11B2ABCC9IDO1KCNE1KCNQ1
SCHEMBL9805010 0.79 CYP11B2 (0.42) CYP11B2IDO1TDO2KCNH2HTR2B
SCHEMBL2818767 0.79 CYP11B2 (0.42) CYP11B2ABCC9IDO1TDO2KCNE1
SCHEMBL2818768 0.79 CYP11B2 (0.42) CYP11B2ABCC9IDO1TDO2KCNE1
SCHEMBL2824085 0.79 CYP11B2 (0.42) CYP11B2ABCC9IDO1TDO2KCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436035-B2 Organic compounds NOVARTIS AG (CH) 2013-05-07 US disclosed
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
US-20100048562-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-25 US disclosed
US-20100048562-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-25 US 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
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 6/4885ABCC9 562/4885IDO1 1361/4885

“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.