SCHEMBL14944630

SCHEMBL14944630

NC1NC(c2ncc[nH]2)=Nc2c1[nH]c(=O)n2Cc1ccc2c(c1)CNCC2

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
USP28 Q96RU2 1/20 0.32
USP25 Q9UHP3 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
SCHEMBL20343751 0.82 PNP (0.38)
SCHEMBL20343773 0.80 KMT2A (0.37)
SCHEMBL14944751 0.73 TLR7 (0.41)
SCHEMBL20343831 0.68 HPGD (0.38)
SCHEMBL14944679 0.62 TLR7 (0.38)
SCHEMBL20343766 0.61 DRD2 (0.42)
SCHEMBL20343784 0.60 DRD2 (0.39)
SCHEMBL20343757 0.59 TLR7 (0.41)
SCHEMBL20343814 0.58 USP1 (0.37)
SCHEMBL14944713 0.57 ADORA1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013068438-A1 PURINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN R&D IRELAND (IE) 2013-05-16 WO disclosed