SCHEMBL112637

SCHEMBL112637

CON(C)C(=O)c1ccnc(-c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 2/20 0.46
KDM4C Q9H3R0 3/20 0.46
KDM4E B2RXH2 2/20 0.46
KDM6B O15054 2/20 0.46
KDM5C P41229 2/20 0.46
KDM2A Q9Y2K7 2/20 0.46
KDM3A Q9Y4C1 2/20 0.46
KDM4A O75164 1/20 0.44
ACACB O00763 1/20 0.42
ACACA Q13085 1/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
ASIC3 Q9UHC3 1/20 0.41
HTR1A P08908 1/20 0.41
HTR7 P34969 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
ADORA2A P29274 1/20 0.41
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMO O15229 1/20 0.40

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
SCHEMBL2128098 0.84 HDAC1 (0.44) KDM4CKDM4EKDM6BKDM5CKDM2A
SCHEMBL2126899 0.81 KDM1A (0.54) KDM4CKDM4AEGFR
SCHEMBL772236 0.80 KMO (0.53) KMO
SCHEMBL2128846 0.80 KDM4C (0.40) KAT6AKDM4CKDM4EKDM6BKDM5C
SCHEMBL581398 0.79 KDM4E (0.71) KAT6AKDM4CKDM4EKDM6BKDM5C
SCHEMBL15635968 0.79 MLYCD (0.37) KDM4CKDM4EKDM6BKDM5CKDM2A
SCHEMBL20023721 0.78 LDHA (0.59) RAB9ASMN1; SMN2LDHA
SCHEMBL8817882 0.78 ABL1 (0.48)
SCHEMBL28777 0.78 MLYCD (0.54) KDM4ERAB9A
SCHEMBL2837585 0.77 KMT2A (0.50) RAB9ASMN1; SMN2LDHA

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
EP-2424843-B1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES NOVARTIS AG (CH) 2014-03-26 EP disclosed
EP-2424843-B1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES NOVARTIS AG (CH) 2014-03-26 EP disclosed
US-8598217-B2 Imidazole derivatives and their use as modulators of cyclin dependent kinases ASTEX THERAPEUTICS LTD. (GB) 2013-12-03 US disclosed
US-20120101064-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES ASTEX THERAPEUTICS LIMITED (GB) 2012-04-26 US disclosed
US-20120101064-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES ASTEX THERAPEUTICS LIMITED (GB) 2012-04-26 US disclosed
US-20120101064-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES ASTEX THERAPEUTICS LIMITED (GB) 2012-04-26 US disclosed
EP-2424843-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES Novartis AG (CH) 2012-03-07 EP disclosed
WO-2010125402-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES NOVARTIS AG (CH) 2010-11-04 WO disclosed
WO-2010125402-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES NOVARTIS AG (CH) 2010-11-04 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-20120101064-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES CDK3, CCNI, CDK1 KAT6A 1411/4885KDM4C 858/4885KDM4E 1090/4885

“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.