SCHEMBL5488336

SCHEMBL5488336

Nc1ncc(-c2cc[c]cc2)cc1OCc1c(F)cc(F)cc1F

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MET P08581 7/20 0.48
MAP4K4 O95819 2/20 0.42
JAK2 O60674 4/20 0.39
MAP4K3 Q8IVH8 1/20 0.39
FYN P06241 4/20 0.38
MAPK14 Q16539 1/20 0.35
TNIK Q9UKE5 1/20 0.34
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33
TGFBR1 P36897 1/20 0.33
DHFR P00374 1/20 0.33
DCPS Q96C86 1/20 0.33

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
SCHEMBL5484313 0.90 MET (0.54) METMAP4K4JAK2MAP4K3FYN
SCHEMBL28756897 0.84 MET (0.51) METMAP4K4JAK2MAP4K3
SCHEMBL6364739 0.80 MET (0.75) METMAP4K4JAK2MAP4K3
Water SCHEMBL28122580 0.79 MET (0.56) METMAP4K4JAK2MAP4K3FYN
SCHEMBL487796 0.77 MET (0.57) METMAP4K4JAK2MAP4K3FYN
SCHEMBL487592 0.75 MET (0.73) METMAP4K4FYNTNIKTGFBR1
SCHEMBL30452529 0.75 MET (0.73) METMAP4K4FYNTNIKTGFBR1
SCHEMBL487622 0.73 MET (0.52) METMAP4K4JAK2MAP4K3FYN
SCHEMBL488042 0.72 MET (0.79) METMAP4K4JAK2MAP4K3FYN
SCHEMBL3122066 0.71 MET (0.56) METMAP4K4JAK2MAP4K3FYN

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-7230098-B2 2-amino- pyridines and pyrazines additionally substituted witn one or more carbocyclic or heterocyclic groups, e.g., 4-[6-amino-5-(2,6-dichloro-benzyloxy)-pyridin-3-yl]-phenol, for treating many kinds of cancer SUGEN, INC. (US) 2007-06-12 US disclosed
US-20050009840-A1 2-amino- pyridines and pyrazines additionally substituted witn one or more carbocyclic or heterocyclic groups, e.g., 4-[6-amino-5-(2,6-dichloro-benzyloxy)-pyridin-3-yl]-phenol, for treating many kinds of cancer SUGEN, INC. 2005-01-13 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-20050009840-A1 2-amino- pyridines and pyrazines additionally substituted witn one or more carbocyclic or heterocyclic groups, e.g., 4-[6-amino-5-(2,6-dichloro-benzyloxy)-pyridin-3-yl]-phenol, for treating many kinds of cancer MET, ERBB2, CDK4 MET 1/4885MAP4K4 40/4885JAK2 8/4885

“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.