SCHEMBL2218608

SCHEMBL2218608

CC(O)c1ccc2c(c1)NC(=O)CC2

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 1/20 0.54
NPC1 O15118 1/20 0.47
MAPK13 O15264 1/20 0.47
MAPK12 P53778 1/20 0.47
MAPK11 Q15759 1/20 0.47
MAPK14 Q16539 1/20 0.47
KIF11 P52732 1/20 0.43
MAOA P21397 9/20 0.43
MAOB P27338 9/20 0.43
CRBN Q96SW2 1/20 0.43
KCNH2 Q12809 2/20 0.42
SMYD3 Q9H7B4 2/20 0.41
NOX1 Q9Y5S8 1/20 0.41
AOC3 Q16853 1/20 0.40

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
SCHEMBL8917088 0.87 KCNH2 (0.53) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL2611058 0.87 CA9 (0.57) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL29754329 0.87 CA9 (0.57) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL29337400 0.84 CA9 (0.58) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL4259653 0.83 CA9 (0.50) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL1890344 0.83 CA9 (0.50) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL1880793 0.82 CA9 (0.53) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL1880791 0.82 CA9 (0.53) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL1885817 0.80 CA9 (0.50) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL18500484 0.79 CA9 (0.53) CA9NPC1MAPK13MAPK12MAPK11

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
CN-102239159-B 7-piperidinoalkyl-3,4-dihydroquinolone derivative TAISHO PHARMACEUTICAL CO LTD 2014-06-25 CN disclosed
EP-2344471-B1 7-PIPERIDINOALKYL-3,4-DIHYDROQUINOLONE DERIVATIVE TAISHO PHARMACEUTICAL CO LTD (JP) 2013-07-24 EP disclosed
US-8461182-B2 7-piperidinoalkyl-3, 4-Dihydroquinolone derivative TAISHO PHARMACEUTICAL CO., LTD. (JP) 2013-06-11 US disclosed
US-20110178304-A1 7-PIPERIDINOALKYL-3, 4-DIHYDROQUINOLONE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-07-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110178304-A1 7-PIPERIDINOALKYL-3, 4-DIHYDROQUINOLONE DERIVATIVE MCHR1, MCHR2, GPR119 CA9 4726/4885NPC1 355/4885MAPK13 1588/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.