SCHEMBL4046071

SCHEMBL4046071

FC(F)(F)Oc1ccc(Nc2[nH]nc3c2Cc2cc(Cl)ccc2-3)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.42
CHRNA7 P36544 3/20 0.39
DHODH Q02127 1/20 0.39
PDGFRB P09619 2/20 0.39
ALOX5 P09917 1/20 0.38
TRPA1 O75762 1/20 0.36
ABL1 P00519 5/20 0.36
PLK1 P53350 1/20 0.36
KIT P10721 1/20 0.35
FLT1 P17948 1/20 0.35
KDR P35968 1/20 0.35
BCR P11274 2/20 0.35
TRPV1 Q8NER1 1/20 0.34

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
SCHEMBL4047143 0.88 CHEK1 (0.42) CHEK1CHRNA7DHODHPDGFRBTRPA1
SCHEMBL4041878 0.87 PDGFRB (0.48) CHEK1CHRNA7DHODHPDGFRB
SCHEMBL4047789 0.86 TRPA1 (0.42) CHEK1DHODHPDGFRBALOX5TRPA1
SCHEMBL4048808 0.86 PLK1 (0.48) CHEK1PDGFRBPLK1
SCHEMBL4040474 0.83 PDGFRB (0.48) CHEK1CHRNA7DHODHPDGFRBKIT
SCHEMBL4041668 0.83 CHEK1 (0.42) CHEK1CHRNA7DHODHPDGFRBTRPA1
SCHEMBL4044890 0.82 CHEK1 (0.49) CHEK1PDGFRBABL1FLT1KDR
SCHEMBL4045873 0.82 PDGFRB (0.42) CHEK1PDGFRBPLK1KITFLT1
SCHEMBL4050596 0.82 ACHE (0.47) CHEK1PDGFRBABL1PLK1KDR
SCHEMBL4050715 0.81 PDGFRB (0.37) CHEK1PDGFRBALOX5TRPA1KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795440-B2 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHARMACEUTICA NV (BE) 2010-09-14 US disclosed
US-7795440-B2 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHARMACEUTICA NV (BE) 2010-09-14 US disclosed
EP-1506175-B1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-04-01 EP disclosed
CN-100396670-C N-substituted 3-aminobenzene-pyrazoles as PDFG receptor inhibitors, pharmaceutical compositions and uses JANSSEN PHARMACEUTICA NV (BE) 2008-06-25 CN disclosed
US-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders HO CHIH Y 2007-06-21 US disclosed
US-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders HO CHIH Y 2007-06-21 US disclosed
US-7196110-B2 N-substituted tricyclic 3-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHAMACEUTICA N.V. (BE) 2007-03-27 US disclosed
US-7196110-B2 N-substituted tricyclic 3-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHAMACEUTICA N.V. (BE) 2007-03-27 US disclosed
CN-1668601-A N-substituted tricyclic 3-aminopyrazoles as PDFG receptor inhibitors JANSSEN PHARMACEUTICA NV (BE) 2005-09-14 CN 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-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders PDGFRA, PDGFRB, PDGFA CHEK1 152/4885CHRNA7 4070/4885DHODH 1704/4885

“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.