SCHEMBL9353375

SCHEMBL9353375

CCCC(=O)c1cnc2ccc(OCCN(C)C)cc2c1Nc1ccccc1C

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ATP4A P20648 1/20 0.54
▸ ATP4B P51164 1/20 0.54

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
SCHEMBL9353356 0.95 ATP4A (0.53) ATP4AATP4B
SCHEMBL7180952 0.90 ATP4A (0.56) ATP4AATP4B
SCHEMBL9513429 0.89 ATP4A (0.58) ATP4AATP4B
SCHEMBL8187805 0.88 ATP4A (0.52) ATP4AATP4B
SCHEMBL9353390 0.87 ATP4A (0.49) ATP4AATP4B
SCHEMBL7187992 0.87 ATP4A (0.64) ATP4AATP4B
SCHEMBL9513098 0.86 ATP4A (0.53) ATP4AATP4B
SCHEMBL9350578 0.84 — —
SCHEMBL9349865 0.84 ATP4A (0.47) ATP4AATP4B
SCHEMBL9349728 0.84 — —

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-0416749-B1 Substituted 4-aminoquinolines SMITHKLINE BEECHAM INTERCREDIT (NL) 1994-08-17 — — EP claimed
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