SCHEMBL824664

SCHEMBL824664

CN(CCNC(=O)OC(C)(C)C)c1ccc2cc(-c3ccccc3OC(F)(F)F)[nH]c(=O)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SUV39H2 Q9H5I1 2/20 0.39
CKS1B P61024 1/20 0.39
SKP1 P63208 1/20 0.39
SKP2 Q13309 1/20 0.39
FFAR1 O14842 1/20 0.39
MALT1 Q9UDY8 1/20 0.37
PDK2 Q15119 1/20 0.36
KIT P10721 1/20 0.36
ABL1 P00519 1/20 0.34
BCHE P06276 1/20 0.34
NQO2 P16083 1/20 0.34
EGFR P00533 1/20 0.34
RORC P51449 1/20 0.34
JAK3 P52333 1/20 0.34
PDPK1 O15530 1/20 0.34
CCNB2 O95067 1/20 0.34
PRKCB P05771 1/20 0.34
CDK1 P06493 1/20 0.34
LYN P07948 1/20 0.34
CCNB1 P14635 1/20 0.34

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
SCHEMBL2710616 0.90 FFAR1 (0.43) FFAR1KITABL1EGFRRORC
SCHEMBL824728 0.84 FFAR1 (0.43) FFAR1KITABL1EGFRSCN9A
SCHEMBL824740 0.82 FFAR1 (0.41) FFAR1KITABL1EGFRRORC
SCHEMBL827610 0.82 FFAR1 (0.44) FFAR1KITABL1EGFRRORC
Trifluoroacetic Acid SCHEMBL828181 0.81 FFAR1 (0.45) FFAR1KITABL1EGFRRORC
SCHEMBL824929 0.78 FFAR1 (0.45) FFAR1KITABL1EGFRSCN9A
SCHEMBL827412 0.76 FFAR1 (0.46) FFAR1KITABL1EGFRRORC
SCHEMBL824722 0.76 NTSR1 (0.42) FFAR1DRD2
SCHEMBL824819 0.72 KIT (0.45) FFAR1KITABL1RORC
SCHEMBL824597 0.72 FFAR1 (0.45) FFAR1KITABL1BCHEEGFR

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-8143274-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-03-27 US disclosed
US-8143274-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-03-27 US disclosed
US-20070185160-A1 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-08-09 US disclosed
US-20070185160-A1 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-08-09 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-20070185160-A1 1-(2H)-isoquinolone derivative NR3C2, NR1H4, NR3C1 SUV39H2 4223/4885CKS1B 1733/4885SKP1 2910/4885

“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.