SCHEMBL20154908

SCHEMBL20154908

CC(C)(C)OC(=O)NCCNc1nc(N)ncc1-c1cccc(F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.44
FEN1 P39748 3/20 0.44
STK17B O94768 1/20 0.43
STK17A Q9UEE5 1/20 0.43
LATS1 O95835 1/20 0.43
MALT1 Q9UDY8 1/20 0.42
BCHE P06276 1/20 0.41
BRD4 O60885 2/20 0.41
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40
PDGFRB P09619 3/20 0.40
FGFR1 P11362 3/20 0.40
PDGFRA P16234 3/20 0.40
IRAK1 P51617 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
SRC P12931 2/20 0.39
ATR Q13535 1/20 0.39
ITK Q08881 2/20 0.38
EGFR P00533 1/20 0.38

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
SCHEMBL20155234 0.78 IRAK1 (0.51) STK17BSTK17ALATS1IRAK1IRAK4
SCHEMBL20154907 0.76 STK17B (0.49) STK17BSTK17ALATS1MALT1BCHE
SCHEMBL19490770 0.73 MALT1 (0.48) ALOX5APFEN1STK17BSTK17ALATS1
SCHEMBL3336071 0.70 HRH4 (0.60) ALOX5APLATS1BCHE
SCHEMBL20154893 0.69 IRAK4 (0.55) IRAK1IRAK4
SCHEMBL4099481 0.69 ACP1 (0.53) FGFR1IRAK4
SCHEMBL4269455 0.69 LATS1 (0.50) STK17BSTK17ALATS1MALT1BCHE
SCHEMBL4112500 0.69 ACP1 (0.50) FGFR1IRAK1IRAK4
SCHEMBL4113143 0.69 IRAK4 (0.44) IRAK1IRAK4
SCHEMBL19591348 0.68 MALT1 (0.49) MALT1BCHEBRD4

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-10822327-B2 2-substituted aromatic ring-pyrimidine derivative and preparation and application thereof ZHEJIANG UNIVERSITY (CN) 2020-11-03 US disclosed
WO-2018086547-A1 2-SUBSTITUTED AROMATIC RING-PYRIMIDINE DERIVATIVE, AND PREPARATION AND APPLICATION THEREOF 浙江大学 2018-05-17 WO 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-10822327-B2 2-substituted aromatic ring-pyrimidine derivative and preparation and application thereof CHEK1, CHEK2, PLK1 ALOX5AP 4468/4885FEN1 405/4885STK17B 206/4885

“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.