SCHEMBL6694499

SCHEMBL6694499

NCc1cccc2nc(N)[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MASP2 O00187 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
NUDT1 P36639 1/20 0.46
KMT2A Q03164 1/20 0.46
AOC3 Q16853 1/20 0.46
QTRT1 Q9BXR0 1/20 0.41
PNMT P11086 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.35
TYMS P04818 5/20 0.35
ATP4A P20648 3/20 0.35
ATP4B P51164 3/20 0.35
PIM1 P11309 1/20 0.33
PLAU P00749 1/20 0.33
HTR3E A5X5Y0 1/20 0.33
HTR3B O95264 1/20 0.33
HTR3A P46098 1/20 0.33
BACE1 P56817 1/20 0.33
HTR3D Q70Z44 1/20 0.33
HTR3C Q8WXA8 1/20 0.33

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
SCHEMBL13058007 0.84 TYMS (0.47) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL14365376 0.84 MEN1 (0.44) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL1075198 0.80 MEN1 (0.41) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL5071828 0.80 LTB4R (0.50) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL29091111 0.78 TLR8 (0.48) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL15553342 0.77 TLR8 (0.49) TLR8
SCHEMBL3287768 0.76 ALDH1A1 (0.52) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL27681188 0.76 TLR8 (0.50) ALDH1A1TLR8
SCHEMBL18340923 0.73 MASP2 (0.48) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL21708401 0.73 ALDH1A1 (0.48) MASP2MEN1ALDH1A1NUDT1KMT2A

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-2004050035-A2 BENZIMIDAZOLES AND ANALOGS THEREOF AS ANTIVIRALS ISIS PHARMACEUTICALS, INC. (US) 2004-06-17 WO disclosed