SCHEMBL20081952

SCHEMBL20081952

CN(N)C(=O)c1ccccc1-c1cc(N2CCOCC2)nc2c(-c3ccn[nH]3)nccc12

nearest known ligand 0.88

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 20/20 0.88
▸ ATRIP Q8WXE1 20/20 0.88

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
SCHEMBL18110036 0.94 ATR (1.00) ATRATRIP
SCHEMBL18110037 0.84 ATR (1.00) ATRATRIP
SCHEMBL30140510 0.83 ATR (1.00) ATRATRIP
SCHEMBL30140422 0.83 ATR (1.00) ATRATRIP
SCHEMBL17501237 0.83 ATR (1.00) ATRATRIP
SCHEMBL17501578 0.83 ATR (1.00) ATRATRIP
SCHEMBL17501580 0.82 ATR (0.81) ATRATRIP
SCHEMBL18109996 0.81 ATR (1.00) ATRATRIP
SCHEMBL20082114 0.81 ATR (0.84) ATRATRIP
SCHEMBL23837823 0.81 ATR (0.79) ATRATRIP

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
EP-3177619-B1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES Bayer Pharma AG (DE) 2018-04-25 — — EP disclosed
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