SCHEMBL3342973

SCHEMBL3342973

CN(C)c1cc(Nc2nc(Cl)ncc2F)n[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
JAK2 O60674 6/20 0.41
JAK3 P52333 4/20 0.41
IGF1R P08069 1/20 0.41
PLK4 O00444 2/20 0.40
PAK4 O96013 2/20 0.40
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NTRK1 P04629 6/20 0.38
AURKA O14965 2/20 0.35
RET P07949 2/20 0.35
FLT3 P36888 2/20 0.35
PTK2B Q14289 2/20 0.35
STK10 O94804 1/20 0.35
FGFR1 P11362 1/20 0.35
FER P16591 1/20 0.35
CSNK2A2 P19784 1/20 0.35

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
SCHEMBL3337463 0.88 MEN1 (0.42) KMT2AJAK2JAK3IGF1RPLK4
SCHEMBL219315 0.83 PLK4 (0.58) KMT2AJAK2JAK3IGF1RPLK4
SCHEMBL3856477 0.80 GRK6 (0.45) JAK2JAK3IGF1RPLK4PAK4
SCHEMBL4076654 0.78 ALDH1A1 (0.43) KMT2AJAK2JAK3IGF1RPLK4
SCHEMBL4064988 0.77 JAK2 (0.43) KMT2AJAK2JAK3IGF1RPLK4
SCHEMBL220033 0.76 IGF1R (0.66) JAK2IGF1RNTRK1
SCHEMBL14723307 0.74 IGF1R (0.61) KMT2AJAK2IGF1RNTRK1
SCHEMBL218749 0.70 JAK2 (0.76) JAK2JAK3IGF1RPLK4PAK4
SCHEMBL655400 0.69 SYK (0.46) KMT2AIGF1RALDH1A1L3MBTL1MEN1
SCHEMBL657274 0.69 ALDH1A1 (0.43) KMT2AALDH1A1L3MBTL1MEN1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1945631-B1 4- (3-AMINOPYRAZOLE) PYRIMIDINE DERIVATIVES FOR USE AS TYROSINE KINASE INHIBITORS IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2012-08-08 EP disclosed
US-20100160325-A1 4-(3-AMINOPYRAZOLE) PYRIMIDINE DERIVATIVES FOR USE AS TYROSINE KINASE INHIBITORS IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2010-06-24 US disclosed
US-20080287475-A1 4-(3-Aminopyrazole) Pyrimidine Derivatives for Use as Tyrosine Kinase Inhibitors in the Treatment of Cancer ASTRAZENECA AB (SE) 2008-11-20 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 (2 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-20080287475-A1 4-(3-Aminopyrazole) Pyrimidine Derivatives for Use as Tyrosine Kinase Inhibitors in the Treatment of Cancer ABL1, FLT3, ERBB2 KMT2A 1276/4885JAK2 35/4885JAK3 13/4885
US-20100160325-A1 4-(3-AMINOPYRAZOLE) PYRIMIDINE DERIVATIVES FOR USE AS TYROSINE KINASE INHIBITORS IN THE TREATMENT OF CANCER ABL1, FLT3, ERBB2 KMT2A 1276/4885JAK2 35/4885JAK3 13/4885

“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.