SCHEMBL13028186

SCHEMBL13028186

CC(C)(C)OC(=O)N(c1ccc(Cl)cc1)c1cncc(-c2cc[nH]n2)n1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MT-CO2 P00403 1/20 0.43
RORC P51449 1/20 0.33
SCN2A Q99250 2/20 0.31
SCN10A Q9Y5Y9 2/20 0.31
PAX8 Q06710 1/20 0.31
CYP1A2 P05177 2/20 0.30
CYP3A4 P08684 2/20 0.30
CYP2C9 P11712 2/20 0.30
CYP2C19 P33261 2/20 0.30
CYP2D6 P10635 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
SCHEMBL2892672 0.84 MT-CO2 (0.43) MT-CO2RORCCYP1A2CYP3A4CYP2C9
SCHEMBL2891573 0.83 MT-CO2 (0.43) MT-CO2RORCSCN2ASCN10APAX8
SCHEMBL2889310 0.82 MT-CO2 (0.42) MT-CO2RORCPAX8CYP1A2CYP3A4
SCHEMBL2890838 0.82 MT-CO2 (0.49) MT-CO2RORCPAX8
SCHEMBL2889485 0.82 MT-CO2 (0.43) MT-CO2RORCSCN2ASCN10APAX8
SCHEMBL2890768 0.81 MT-CO2 (0.41) MT-CO2RORC
SCHEMBL2889186 0.81 CNR1 (0.44) MT-CO2RORCSCN2ASCN10APAX8
SCHEMBL2885431 0.78 MT-CO2 (0.41) MT-CO2RORCPAX8CYP1A2CYP2C9
SCHEMBL2889103 0.76 MT-CO2 (0.41) MT-CO2RORCSCN2ASCN10A
SCHEMBL2893038 0.75 KDR (0.41) MT-CO2RORCPAX8CYP1A2CYP2C9

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-8415358-B2 Pyrazine derivatives and their use as potassium channel modulators NEUROSEARCH A/S (DK) 2013-04-09 US disclosed
US-20100286161-A1 PYRAZINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2010-11-11 US disclosed
WO-2009037247-A1 PYRAZINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2009-03-26 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-20100286161-A1 PYRAZINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS KCNJ2, KCNQ5, KCNA5 MT-CO2 2921/4885RORC 1230/4885SCN2A 59/4885

“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.