SCHEMBL20081972

SCHEMBL20081972

COc1nccc(-c2cc(N3CCOCC3C)nc3c(-c4ccn[nH]4)nccc23)c1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 20/20 1.00
▸ ATRIP Q8WXE1 20/20 1.00

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
SCHEMBL29398764 1.00 ATR (1.00) ATRATRIP
SCHEMBL17501542 1.00 ATR (1.00) ATRATRIP
SCHEMBL17501566 0.89 ATR (1.00) ATRATRIP
SCHEMBL30140508 0.89 ATR (1.00) ATRATRIP
SCHEMBL17501390 0.88 ATR (1.00) ATRATRIP
SCHEMBL30140466 0.88 ATR (1.00) ATRATRIP
SCHEMBL17501562 0.86 ATR (1.00) ATRATRIP
SCHEMBL17527632 0.85 ATR (1.00) ATRATRIP
SCHEMBL30140478 0.85 ATR (1.00) ATRATRIP
SCHEMBL17501491 0.84 ATR (0.83) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3395818-B1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES Bayer Pharma AG (DE) 2021-09-22 — — EP disclosed
EP-3177619-B1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES Bayer Pharma AG (DE) 2018-04-25 — — EP disclosed
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