SCHEMBL9260552

SCHEMBL9260552

CCCC(=O)c1cnc2c(O)cccc2c1Nc1ccccc1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ATP4A P20648 1/20 0.76
▸ ATP4B P51164 1/20 0.76

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
SCHEMBL9272822 0.92 ATP4A (0.64) ATP4AATP4B
SCHEMBL9650832 0.92 ATP4A (0.80) ATP4AATP4B
SCHEMBL9723909 0.88 ATP4A (0.74) ATP4AATP4B
SCHEMBL9270832 0.88 ATP4A (0.74) ATP4AATP4B
SCHEMBL9349742 0.88 ATP4A (0.74) ATP4AATP4B
SCHEMBL9723915 0.87 ATP4A (0.73) ATP4AATP4B
SCHEMBL9271880 0.86 — —
SCHEMBL9723912 0.86 ATP4A (0.74) ATP4AATP4B
SCHEMBL9272700 0.86 ATP4A (0.71) ATP4AATP4B
SCHEMBL9723910 0.86 ATP4A (0.78) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5432182-A Inhibitors of gastric acid secretion SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1995-07-11 — — US disclosed
EP-0416749-B1 Substituted 4-aminoquinolines SMITHKLINE BEECHAM INTERCREDIT (NL) 1994-08-17 — — EP disclosed
EP-0330485-B1 4-AMINO-3-ACYL QUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF GASTRIC ACID SECRETION SmithKline Beecham Intercredit B.V. (NL) 1993-05-26 — — EP disclosed
US-5089504-A SUBSTITUTED 4-AMINOQUINOLINE DERIVATIVES AS GASTRIC ACID SECRETION INHIBITORS SMITHKLINE BECKMAN INTERCREDIT B.V. (NL) 1992-02-18 — — US disclosed
US-5082841-A Enzyme inhibitor SMITHKLINE BEECHAM INTERCREDIT B.V. (GB) 1992-01-21 — — US disclosed
EP-0416749-A2 Substituted 4-aminoquinolines SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1991-03-13 — — EP disclosed
WO-1989008104-A1 4-AMINO-3-ACYLQUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF GASTRIC SECRETION SMITHKLINE BECKMAN INTERCREDIT B.V. (NL) 1989-09-08 — — WO disclosed
EP-0330485-A1 4-Amino-3-acyl quinoline derivatives and their use as inhibitors of gastric acid secretion SmithKline Beecham Intercredit B.V. (NL) 1989-08-30 — — EP disclosed
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