SCHEMBL10499317

SCHEMBL10499317

CCCC(=O)c1cnc2ccccc2c1Nc1ccccc1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ATP4A P20648 1/20 0.68
▸ ATP4B P51164 1/20 0.68

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
SCHEMBL9650997 0.89 ATP4A (0.60) ATP4AATP4B
SCHEMBL9650832 0.87 ATP4A (0.80) ATP4AATP4B
SCHEMBL9270740 0.86 ATP4A (0.57) ATP4AATP4B
SCHEMBL9260685 0.86 ATP4A (0.57) ATP4AATP4B
SCHEMBL7187992 0.85 ATP4A (0.64) ATP4AATP4B
SCHEMBL10498699 0.85 ATP4A (0.67) ATP4AATP4B
SCHEMBL9514412 0.84 ATP4A (0.56) ATP4AATP4B
SCHEMBL10532343 0.84 — —
SCHEMBL9260552 0.84 ATP4A (0.76) ATP4AATP4B
Hydrochloric Acid SCHEMBL8537632 0.84 CSF1R (0.54) —

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4806549-A INHIBITOR OF GASTRIC ACID SECRETION SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1989-02-21 — — US disclosed
US-4806550-A 4-Amino-3-carbonyl substituted quinolines as inhibitors of gastric acid secretion SMITHKLINE & FRENCH LABORATORIES LIMITED (GB) 1989-02-21 — — US disclosed
WO-1988001621-A1 4-AMINOQUINOLINE DERIVATIVES AND THEIR USE AS MEDICAMENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1988-03-10 — — WO disclosed
EP-0259174-A1 Derivatives of 4-aminoquinoline and their use as medicaments SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1988-03-09 — — EP disclosed
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