SCHEMBL2819443

SCHEMBL2819443

CC1(C)[C@H](O)c2ccccc2[C@H]1n1cncc1CO

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 3/20 0.46
IDO1 P14902 13/20 0.37
TDO2 P48775 8/20 0.37
CYP3A4 P08684 1/20 0.32
POLB P06746 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
SCHEMBL2819445 1.00 CYP11B2 (0.46) CYP11B2IDO1TDO2CYP3A4POLB
SCHEMBL2819441 1.00 CYP11B2 (0.46) CYP11B2IDO1TDO2CYP3A4POLB
SCHEMBL2817116 0.80 IDO1 (0.34) CYP11B2IDO1
SCHEMBL2818872 0.76 CYP11B2 (0.52) CYP11B2IDO1TDO2
SCHEMBL2818681 0.76 CYP11B2 (0.52) CYP11B2IDO1TDO2
SCHEMBL2819320 0.76 CYP11B2 (0.52) CYP11B2IDO1TDO2
SCHEMBL2818690 0.76 CYP11B2 (0.47) CYP11B2IDO1TDO2
SCHEMBL2818687 0.76 CYP11B2 (0.47) CYP11B2IDO1TDO2
SCHEMBL2816867 0.76 CYP11B2 (0.47) CYP11B2IDO1TDO2CYP3A4
SCHEMBL843195 0.76 CYP11B2 (0.69) CYP11B2IDO1TDO2POLB

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 3 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

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 1361/4885TDO2 1757/4885

“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.