SCHEMBL2838149

SCHEMBL2838149

Nc1nc(N=C=O)nc(N=C=O)n1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 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
SCHEMBL19837947 0.95 CYP3A4 (0.30) CYP3A4
SCHEMBL8151960 0.75 HSP90AA1 (0.32)
SCHEMBL484030 0.74
SCHEMBL11797450 0.74 ALDH1A1 (0.35)
SCHEMBL14174105 0.74 CYP3A4 (0.34) CYP3A4
SCHEMBL14184754 0.70 MAPK1 (0.30)
SCHEMBL8607397 0.69
SCHEMBL9202653 0.68 ALDH1A1 (0.42)
SCHEMBL713341 0.68 CYP3A4 (0.30) CYP3A4
SCHEMBL10957827 0.67 MAPK1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010066686-A2 NOVEL TRIAZINE POLYMERS, METHOD FOR THE PRODUCTION AND USE THEREOF BOREALIS AGROLINZ MELAMINE GMBH (AT) 2010-06-17 WO claimed
WO-2010066686-A2 NOVEL TRIAZINE POLYMERS, METHOD FOR THE PRODUCTION AND USE THEREOF BOREALIS AGROLINZ MELAMINE GMBH (AT) 2010-06-17 WO disclosed