SCHEMBL18148256

SCHEMBL18148256

CC(C)c1nc2nc(NC3CCC(N)CC3)ncc2c(=O)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 5/20 0.50
▸ MAPK10 P53779 3/20 0.50
▸ MAPK9 P45984 3/20 0.41
▸ CDK9 P50750 13/20 0.40
▸ CDK7 P50613 12/20 0.40
▸ MERTK Q12866 1/20 0.39
▸ CCNB2 O95067 1/20 0.39
▸ CDK1 P06493 1/20 0.39
▸ CCNB1 P14635 1/20 0.39
▸ CCNB3 Q8WWL7 1/20 0.39
▸ CSNK1A1 P48729 2/20 0.37
▸ CCNK O75909 1/20 0.37
▸ CDK13 Q14004 1/20 0.37
▸ CDK12 Q9NYV4 1/20 0.37
▸ CCNT1 O60563 1/20 0.37
▸ CSNK1D P48730 1/20 0.37
▸ CSNK1E P49674 1/20 0.37
▸ CCNH P51946 1/20 0.37

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
SCHEMBL16802774 1.00 MAPK8 (0.50) MAPK8MAPK10MAPK9CDK9CDK7
SCHEMBL16799802 0.89 MAPK8 (0.50) MAPK8MAPK10MAPK9
SCHEMBL16799805 0.89 MAPK8 (0.50) MAPK8MAPK10MAPK9
SCHEMBL18148240 0.83 MAPK8 (0.63) MAPK8MAPK10MAPK9
SCHEMBL16802775 0.83 MAPK8 (0.63) MAPK8MAPK10MAPK9
SCHEMBL16802605 0.72 MAPK8 (0.55) MAPK8MAPK10MAPK9CDK9CDK7
SCHEMBL18148242 0.72 MAPK8 (0.55) MAPK8MAPK10MAPK9CDK9CDK7
SCHEMBL16802784 0.69 MAPK8 (0.63) MAPK8MAPK10MAPK9CDK9CDK7
SCHEMBL18148274 0.69 MAPK8 (0.63) MAPK8MAPK10MAPK9CDK9CDK7
SCHEMBL16802772 0.67 MAPK8 (1.00) MAPK8MAPK10MAPK9CDK9CDK7

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.

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