SCHEMBL2748338

SCHEMBL2748338

Nc1ncc(-c2cnn(C3CCNCC3)c2)cc1-c1nc2cc(OC(F)(F)F)ccc2s1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRK5 P34947 11/20 0.52
MET P08581 13/20 0.51
KCNH2 Q12809 2/20 0.51
GRK2 P25098 6/20 0.51
FLT3 P36888 3/20 0.51
AURKA O14965 1/20 0.49
MST1R Q04912 1/20 0.49

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
SCHEMBL2749684 0.94 GRK5 (0.54) GRK5METKCNH2GRK2FLT3
SCHEMBL2749144 0.89 GRK5 (0.61) GRK5METKCNH2GRK2FLT3
SCHEMBL2750834 0.88 MAP4K3 (0.57) GRK5METKCNH2GRK2FLT3
SCHEMBL2748605 0.87 GRK5 (0.57) GRK5METKCNH2GRK2FLT3
SCHEMBL2748093 0.86 GRK5 (0.47) GRK5METKCNH2GRK2FLT3
SCHEMBL2749292 0.85 MET (0.56) GRK5METKCNH2GRK2FLT3
SCHEMBL2749754 0.85 MET (0.56) GRK5METKCNH2GRK2FLT3
SCHEMBL2748703 0.85 MET (0.67) GRK5METKCNH2GRK2FLT3
SCHEMBL2385920 0.84 MET (0.66) GRK5METKCNH2GRK2FLT3
SCHEMBL2749263 0.83 GRK5 (0.54) GRK5METKCNH2GRK2FLT3

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-8178668-B2 2-aminopyridine kinase inhibitors OSI Pharmaceuticals, LLC (US) 2012-05-15 US disclosed
US-20090197862-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI PHARMACEUTICALS, INC. 2009-08-06 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-20090197862-A1 2-AMINOPYRIDINE KINASE INHIBITORS ERBB2, ABL2, TIE1 GRK5 317/4885MET 38/4885KCNH2 1141/4885

“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.