SCHEMBL4530608

SCHEMBL4530608

CC(C)CN1[CH]N(C(N)=O)c2ccc(-c3c(-c4ccccc4)nc(-c4c(F)cccc4F)n3C)nc21

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.36
FABP4 P15090 3/20 0.34
FABP5 Q01469 1/20 0.34
FAAH O00519 3/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
PLA2G4A P47712 1/20 0.32
CSNK1D P48730 1/20 0.32
CSNK1E P49674 1/20 0.32
AKT1 P31749 1/20 0.30
AKT2 P31751 1/20 0.30

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
SCHEMBL4530604 0.76 MAPK14 (0.51) MAPK14FABP4FAAHCNR1CNR2
SCHEMBL29593607 0.72 MAPK14 (0.66) MAPK14CSNK1D
SCHEMBL3992817 0.72 MAPK14 (0.66) MAPK14CSNK1D
SCHEMBL5780689 0.68 MAPK14 (0.47) MAPK14FABP4
SCHEMBL4300771 0.66 MAPK14 (0.47) MAPK14FABP4
SCHEMBL4300769 0.66 MAPK14 (0.47) MAPK14FABP4
SCHEMBL29594245 0.61 MAPK14 (0.54) MAPK14
SCHEMBL4069800 0.61 MAPK14 (0.54) MAPK14
SCHEMBL18152791 0.59 FABP4 (0.46) MAPK14FABP4FABP5CNR1AKT1
SCHEMBL4837363 0.59 MAPK14 (0.65) MAPK14CSNK1D

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
US-20090318443-A1 KINASE INHIBITORS BONJOUKLIAN ROSANNE 2009-12-24 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-20090318443-A1 KINASE INHIBITORS MAP3K20, MAP3K19, MAP3K1 MAPK14 174/4885FABP4 4320/4885FABP5 3017/4885

“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.