SCHEMBL4136500

SCHEMBL4136500

Nc1ncc(-c2cnn(C3CCNCC3)c2)cc1-c1nc2cccc(-c3ccc[nH]3)c2s1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MET P08581 11/20 0.55
KCNH2 Q12809 2/20 0.55
MAP4K3 Q8IVH8 2/20 0.51
GRK5 P34947 11/20 0.51
GRK2 P25098 8/20 0.51
FLT3 P36888 4/20 0.51
NTRK1 P04629 1/20 0.47

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
Hydrochloric Acid SCHEMBL2749999 0.99 MET (0.56) METKCNH2MAP4K3GRK5GRK2
SCHEMBL2748933 0.87 MET (0.60) METKCNH2MAP4K3GRK5GRK2
Hydrochloric Acid SCHEMBL2748865 0.86 MET (0.57) METKCNH2MAP4K3GRK5GRK2
SCHEMBL2749789 0.86 MET (0.59) METKCNH2MAP4K3GRK5GRK2
SCHEMBL2747708 0.86 MET (0.59) METKCNH2MAP4K3GRK5GRK2
SCHEMBL2750794 0.86 MET (0.59) METKCNH2MAP4K3GRK5GRK2
SCHEMBL3804458 0.85 GRK5 (0.60) METKCNH2MAP4K3GRK5GRK2
SCHEMBL3803353 0.85 MET (0.56) METKCNH2MAP4K3GRK5GRK2
Hydrochloric Acid SCHEMBL2749705 0.85 GRK5 (0.59) METKCNH2MAP4K3GRK5GRK2
Hydrochloric Acid SCHEMBL2749773 0.85 MET (0.56) METKCNH2MAP4K3GRK5GRK2

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
US-20090197862-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI PHARMACEUTICALS, INC. 2009-08-06 US claimed
US-20090197862-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI PHARMACEUTICALS, INC. 2009-08-06 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 MET 38/4885KCNH2 1141/4885MAP4K3 114/4885

“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.