SCHEMBL19699600

SCHEMBL19699600

CC(C)C(=O)Nc1nccc(-c2cnn(C)c2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 5/20 0.55
CSF1R P07333 1/20 0.49
PDGFRA P16234 1/20 0.49
IDH1 O75874 1/20 0.48
CDC7 O00311 1/20 0.47
ROCK2 O75116 1/20 0.47
ADORA1 P30542 1/20 0.46
JAK2 O60674 1/20 0.46
JAK1 P23458 1/20 0.46
TYK2 P29597 1/20 0.46
STAT3 P40763 1/20 0.46
JAK3 P52333 1/20 0.46
CCNK O75909 1/20 0.45
CDK12 Q9NYV4 1/20 0.45
EGFR P00533 3/20 0.44
IRAK4 Q9NWZ3 2/20 0.44
MKNK2 Q9HBH9 1/20 0.43
CLK2 P49760 1/20 0.43
CLK3 P49761 1/20 0.43
DYRK1A Q13627 1/20 0.43

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
SCHEMBL19706536 0.87 MKNK1 (0.57) MKNK1IDH1ROCK2JAK2JAK1
SCHEMBL19699609 0.78 ADORA1 (0.73) CDC7ADORA1JAK2JAK3
SCHEMBL14705835 0.77 ABL1 (0.58) PDGFRAADORA1EGFR
SCHEMBL19699553 0.77 DYRK1A (0.57) DYRK1A
SCHEMBL19699597 0.76 IDH1 (0.49) IDH1CDC7ADORA1JAK2JAK1
SCHEMBL17767937 0.73 JAK2 (0.53) MKNK1JAK2MKNK2DYRK1A
Hydrochloric Acid SCHEMBL22836886 0.72 JAK2 (0.52) MKNK1JAK2MKNK2DYRK1A
SCHEMBL23275699 0.72 JAK2 (0.53) JAK2JAK1TYK2STAT3JAK3
SCHEMBL16700180 0.71 MKNK1 (0.53) MKNK1JAK2JAK1TYK2STAT3
SCHEMBL18812536 0.71 MKNK1 (1.00) MKNK1JAK2JAK1TYK2STAT3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 US disclosed
US-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 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-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 MKNK1 1033/4885CSF1R 1896/4885PDGFRA 3120/4885

“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.