SCHEMBL9156572

SCHEMBL9156572

CCC(=O)c1cnc2c(OCCOC(=O)CCC(=O)OCCOc3cccc4c(Nc5ccccc5C)c(C(=O)CC)cnc34)cccc2c1Nc1ccccc1C

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ATP4A P20648 1/20 0.67
▸ ATP4B P51164 1/20 0.67

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
SCHEMBL9164194 0.94 ATP4A (0.60) ATP4AATP4B
SCHEMBL9161780 0.92 ATP4A (0.75) ATP4AATP4B
SCHEMBL9165521 0.91 ATP4A (0.71) ATP4AATP4B
SCHEMBL9157119 0.91 ATP4A (0.76) ATP4AATP4B
SCHEMBL9159951 0.89 — —
SCHEMBL9157247 0.89 ATP4A (0.69) ATP4AATP4B
SCHEMBL9156952 0.87 ATP4A (0.70) ATP4AATP4B
SCHEMBL8187339 0.86 ATP4A (0.66) ATP4AATP4B
SCHEMBL9156574 0.85 — —
SCHEMBL8194109 0.85 ATP4A (0.65) ATP4AATP4B

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-0642500-A1 4-AMINO-3-ACYL QUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF GASTRIC ACID SECRETION Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1995-03-15 — — EP disclosed
WO-1993012090-A1 4-AMINO-3-ACYL QUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF GASTRIC ACID SECRETION SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1993-06-24 — — WO disclosed
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