SCHEMBL5487623

SCHEMBL5487623

CC1CN(C(=O)c2ccc(-c3cc(OCc4cccc(F)c4C(F)(F)F)cnc3N)cc2)CC(C)N1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.45
KCNH2 Q12809 9/20 0.44
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
ATR Q13535 4/20 0.37
ABL1 P00519 1/20 0.35
BCR P11274 1/20 0.35
PDE4B Q07343 1/20 0.35

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
SCHEMBL10215501 0.87 MET (0.56) METKCNH2
SCHEMBL30453281 0.87 MET (0.56) METKCNH2
SCHEMBL488207 0.87 MET (0.56) METKCNH2
SCHEMBL10218191 0.77 MET (0.58) METKCNH2
SCHEMBL488693 0.75 MET (0.56) METKCNH2
SCHEMBL30452782 0.75 MET (0.56) METKCNH2
SCHEMBL10270841 0.75 MET (0.66) METKCNH2
SCHEMBL30453289 0.75 MET (0.66) METKCNH2
SCHEMBL488357 0.75 MET (0.66) METKCNH2
SCHEMBL10218163 0.75 MET (0.56) METKCNH2ATR

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 1/4885KCNH2 2370/4885CCNC 64/4885

“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.