SCHEMBL843401

SCHEMBL843401

CC(C)(C)[SiH2]OC(c1ccccc1)(c1ccccc1)c1cncn1C1c2ccccc2N(C(=O)Cc2ccccc2)CC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.33
IDO1 P14902 4/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2B6 P20813 1/20 0.32
CYP11B2 P19099 1/20 0.31
BRS3 P32247 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
SCHEMBL843460 0.78 CYP11B2 (0.41) ALDH1A1HPGDIDO1CYP3A4CYP2D6
SCHEMBL843400 0.76 IDO1 (0.33) ALDH1A1HPGDIDO1CYP3A4CYP2D6
SCHEMBL843399 0.75 IDO1 (0.34) ALDH1A1HPGDIDO1CYP3A4CYP2D6
SCHEMBL842330 0.66 CYP11B2 (0.42) IDO1CYP11B2
SCHEMBL2817119 0.64 IDO1 (0.33) IDO1CYP11B2
SCHEMBL842521 0.64 CYP11B2 (0.43) IDO1CYP11B2
SCHEMBL842704 0.61 CYP11B2 (0.57) CYP3A4CYP11B2
SCHEMBL2817782 0.59 CYP11B2 (0.37) CYP11B2
SCHEMBL843156 0.58 CYP11B2 (0.44) IDO1CYP11B2
SCHEMBL843207 0.58 SMN1; SMN2 (0.42) ALDH1A1HPGDIDO1CYP11B2

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-8143278-B2 Organic compounds NOVARTIS AG (CH) 2012-03-27 US disclosed
US-20100093711-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-04-15 US disclosed
EP-2121652-A1 4-IMIDAZOLYL-1,2,3,4-TETRAHYDROQUINOLINE DERIVATIVES AND THEIR USE AS ALDOSTERONE/11-BETA-HYDROXYLASE INHIBITORS Novartis AG (CH) 2009-11-25 EP disclosed
WO-2008076860-A1 4-IMIDAZOLYL-1,2,3,4-TETRAHYDROQUINOLINE DERIVATIVES AND THEIR USE AS ALDOSTERONE/11-BETA-HYDROXYLASE 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-20100093711-A1 ORGANIC COMPOUNDS CYP11B1, HSD11B1, CYP11B2 ALDH1A1 142/4885HPGD 202/4885IDO1 1639/4885

“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.