SCHEMBL18148246

SCHEMBL18148246

CC(C)NC(=O)NC1CCC(Nc2ncc3ccc(N4CCCC4)nc3n2)CC1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 14/20 0.69
▸ MAPK10 P53779 13/20 0.61
▸ MAPK9 P45984 10/20 0.61
▸ HPGDS O60760 2/20 0.44
▸ DGAT2 Q96PD7 1/20 0.43
▸ CYP11B2 P19099 1/20 0.41
▸ FLT3 P36888 1/20 0.39
▸ TYRO3 Q06418 1/20 0.39
▸ MERTK Q12866 1/20 0.39
▸ GAS6 Q14393 1/20 0.39
▸ HRH4 Q9H3N8 1/20 0.39

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
SCHEMBL16802612 1.00 MAPK8 (0.69) MAPK8MAPK10MAPK9HPGDSDGAT2
SCHEMBL16802607 0.83 MAPK8 (0.64) MAPK8MAPK10MAPK9HPGDS
SCHEMBL18148270 0.83 MAPK8 (0.64) MAPK8MAPK10MAPK9HPGDS
SCHEMBL18148255 0.82 MAPK8 (1.00) MAPK8MAPK10MAPK9DGAT2FLT3
SCHEMBL16802579 0.82 MAPK8 (1.00) MAPK8MAPK10MAPK9DGAT2FLT3
SCHEMBL18148243 0.80 MAPK8 (0.78) MAPK8MAPK10MAPK9DGAT2FLT3
SCHEMBL16802581 0.80 MAPK8 (0.78) MAPK8MAPK10MAPK9DGAT2FLT3
SCHEMBL16802576 0.77 MAPK8 (0.74) MAPK8MAPK10HPGDSDGAT2HRH4
SCHEMBL16802595 0.76 MAPK8 (1.00) MAPK8MAPK10MAPK9
SCHEMBL16802651 0.75 MAPK8 (1.00) MAPK8MAPK10MAPK9

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-20160304466-A1 NOVEL COMPOUNDS AS JNK KINASE INHIBITORS THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2016-10-20 — — 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-20160304466-A1 NOVEL COMPOUNDS AS JNK KINASE INHIBITORS MAPK3, MAP3K3, MAP3K2 MAPK8 55/4885MAPK10 31/4885MAPK9 25/4885

“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.

Send feedback