SCHEMBL843720

SCHEMBL843720

COC(=O)c1cn(C2c3ccccc3NC(=O)C2(C)C)cn1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
EGFR P00533 1/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 1/20 0.34
CYP11B2 P19099 1/20 0.34
ATM Q13315 1/20 0.32
PKM P14618 3/20 0.32
POLB P06746 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
NR1I2 O75469 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HPGDS O60760 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
SCHEMBL842649 0.88 ALDH1A1 (0.41) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL842863 0.86 SNRNP200 (0.38) MEN1KMT2APOLB
SCHEMBL842386 0.76 CYP11B2 (0.48) EGFRKDM4EALDH1A1LMNAMAPT
SCHEMBL842710 0.75 NOTUM (0.39) MEN1KMT2AKDM4EALDH1A1
SCHEMBL841685 0.71 CYP19A1 (0.43) CYP11B2ATMPKMPOLB
SCHEMBL3205266 0.67 KDM4A (0.49) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL842870 0.67 CYP11B2 (0.63) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL842873 0.66 PDK2 (0.44) MEN1KMT2AEGFRKDM4EALDH1A1
SCHEMBL28935063 0.65 KDM5A (0.46) MEN1KMT2AKDM4EALDH1A1ATM
SCHEMBL3201410 0.65 KDM4A (0.42) MEN1KMT2AALDH1A1CYP11B2

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-8143278-B2 Organic compounds NOVARTIS AG (CH) 2012-03-27 US disclosed
US-8143278-B2 Organic compounds NOVARTIS AG (CH) 2012-03-27 US disclosed
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
US-20100093711-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-04-15 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
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 MEN1 1413/4885KMT2A 2784/4885EGFR 4610/4885

“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.