SCHEMBL3138347

SCHEMBL3138347

CN(C)/C=N/C(=O)c1ccnc(-c2ccc(Oc3ccc(Cl)cc3F)cc2)n1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 17/20 0.49
FPR2 P25090 7/20 0.49
MAPT P10636 1/20 0.38
PYGL P06737 1/20 0.37
PYGM P11217 1/20 0.37
IGFBP3 P17936 1/20 0.37

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
SCHEMBL3138353 1.00 SCN9A (0.49) SCN9AFPR2MAPTPYGLPYGM
SCHEMBL27586185 0.85 SCN9A (0.50) SCN9AFPR2IGFBP3
SCHEMBL3138733 0.82 SCN9A (0.55) SCN9AFPR2IGFBP3
SCHEMBL6822861 0.81 SCN9A (0.55) SCN9AFPR2
SCHEMBL3138980 0.81 SCN9A (0.64) SCN9AFPR2
SCHEMBL3129012 0.81 SCN9A (0.55) SCN9AFPR2
SCHEMBL3138877 0.80 SCN9A (0.50) SCN9AFPR2MAPT
SCHEMBL6822958 0.79 SCN9A (0.52) SCN9AFPR2MAPT
SCHEMBL3129152 0.75 SCN9A (0.48) SCN9AFPR2MAPT
SCHEMBL3139930 0.74 SCN9A (0.52) SCN9AFPR2IGFBP3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1265866-B1 ARYL SUBSTITUTED PYRIDINES, PYRIMIDINES, PYRAZINES AND TRIAZINES AND THE USE THEREOF EURO CELTIQUE SA (LU) 2010-07-21 EP disclosed
US-6867210-B2 Aryl substituted pyrimidines EURO-CELTIQUE S.A. (LU) 2005-03-15 US disclosed
US-20050043305-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof EURO-CELTIQUE S.A. (LU) 2005-02-24 US disclosed
US-20040192691-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof EURO-CELTIQUE S.A. 2004-09-30 US disclosed
US-20020040025-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof PURDUE PHARMA L.P. 2002-04-04 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 (3 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-20050043305-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof CACNA1S, CACNA1C, KYNU SCN9A 1288/4885FPR2 813/4885MAPT 585/4885
US-20040192691-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof CACNA1S, KYNU, CACNA1C SCN9A 1388/4885FPR2 656/4885MAPT 326/4885
US-20020040025-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof CACNA1S, KYNU, CACNA1C SCN9A 1388/4885FPR2 656/4885MAPT 326/4885

“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.