SCHEMBL1889868

SCHEMBL1889868

O=C1Nc2cnccc2C(=O)C1c1c(F)cc(F)cc1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 3/20 0.36
GSK3B P49841 2/20 0.36
ROCK2 O75116 1/20 0.36
MAP4K4 O95819 1/20 0.36
PRKACA P17612 1/20 0.36
CDK2 P24941 1/20 0.36
HIPK2 Q9H2X6 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
KDM4C Q9H3R0 1/20 0.34
F7 P08709 2/20 0.33
F3 P13726 2/20 0.33
F10 P00742 1/20 0.33
F11 P03951 2/20 0.32
KLKB1 P03952 2/20 0.32
GSK3A P49840 1/20 0.31
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31
RPS6KA3 P51812 1/20 0.31
JAK2 O60674 1/20 0.31

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
SCHEMBL14621115 1.00 CDC7 (0.36) CDC7GSK3BROCK2MAP4K4PRKACA
SCHEMBL4166555 0.82 TGM2 (0.32)
SCHEMBL14005022 0.78 CYP1A2 (0.36) CLK4SMN1; SMN2
SCHEMBL14608888 0.76 PLK4 (0.38) GSK3BCDK2GSK3ACDK5
SCHEMBL4164860 0.76 PLK4 (0.38) GSK3BCDK2GSK3ACDK5
SCHEMBL1884372 0.74 GSK3B (0.46) GSK3BCDK2GSK3ACDK5CDK5R1
SCHEMBL4164922 0.74 NOTUM (0.31) GSK3BGSK3A
SCHEMBL1890488 0.73 CYP1A2 (0.39) GSK3BGSK3ACDK5CDK5R1NPC1
SCHEMBL4716928 0.73 CYP1A2 (0.34) CLK4SMN1; SMN2
SCHEMBL14608695 0.71 TGM2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947679-B2 Fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-05-24 US disclosed
US-7947679-B2 Fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-05-24 US disclosed
US-7947679-B2 Fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-05-24 US disclosed
US-20060069089-A1 Fungicides SYNGENTA CROP PROTECTION, INC. 2006-03-30 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-20060069089-A1 Fungicides CBR3, TACR3, HCRTR1 CDC7 1109/4885GSK3B 4643/4885ROCK2 2606/4885

“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.