SCHEMBL13987455

SCHEMBL13987455

Cn1cc(-c2[nH]c3cc(NC(=O)C(N)COc4ccc(F)cc4)cc4c3c2C=NNC4=O)cn1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 4/20 0.66
AURKA O14965 3/20 0.66
PDGFRB P09619 3/20 0.66
FLT3 P36888 3/20 0.66
KDR P35968 3/20 0.66
ABL1 P00519 3/20 0.66
AAK1 Q2M2I8 2/20 0.66
PLK4 O00444 2/20 0.66
LCK P06239 2/20 0.66
FYN P06241 2/20 0.66
LYN P07948 2/20 0.66
FGFR1 P11362 2/20 0.66
SRC P12931 2/20 0.66
RPS6KB1 P23443 2/20 0.66
LIMK1 P53667 2/20 0.66
BTK Q06187 2/20 0.66
MARK2 Q7KZI7 2/20 0.66
MINK1 Q8N4C8 2/20 0.66
IRAK4 Q9NWZ3 2/20 0.66
BMPR1B O00238 1/20 0.66

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
SCHEMBL4777303 1.00 CSF1R (0.66) CSF1RAURKAPDGFRBFLT3KDR
SCHEMBL4812793 0.93 AURKA (0.68) CSF1RAURKAPDGFRBFLT3KDR
SCHEMBL13987461 0.93 AURKA (0.68) CSF1RAURKAPDGFRBFLT3KDR
SCHEMBL13987794 0.91 AURKA (0.61) CSF1RAURKAPDGFRBFLT3KDR
SCHEMBL4795374 0.87 AURKA (0.72) CSF1RAURKAPDGFRBFLT3KDR
SCHEMBL13987482 0.87 AURKA (0.72) CSF1RAURKAPDGFRBFLT3KDR
SCHEMBL13987737 0.84 AURKA (0.63) CSF1RAURKAPDGFRBFLT3KDR
SCHEMBL13987820 0.83 AURKA (0.66) CSF1RAURKAPDGFRBFLT3KDR
SCHEMBL4816765 0.82 AURKA (0.69) CSF1RAURKAPDGFRBFLT3KDR
SCHEMBL13987443 0.80 AAK1 (1.00) CSF1RAURKAPDGFRBFLT3KDR

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-7462713-B2 Tricyclic compounds protein kinase inhibitors for enhancing the efficacy of anti-neoplastic agents and radiation therapy AGOURON PHARMACEUTICALS, INC. (US) 2008-12-09 US disclosed
US-20070135415-A1 TRICYCLIC COMPOUNDS PROTEIN KINASE INHIBITORS FOR ENHANCING THE EFFICACY OF ANTI-NEOPLASTIC AGENTS AND RADIATION THERAPY AGOURON PHARMACEUTICALS, INC. 2007-06-14 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-20070135415-A1 TRICYCLIC COMPOUNDS PROTEIN KINASE INHIBITORS FOR ENHANCING THE EFFICACY OF ANTI-NEOPLASTIC AGENTS AND RADIATION THERAPY CHEK1, CHEK2, CHKA CSF1R 921/4885AURKA 122/4885PDGFRB 1080/4885

“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.