SCHEMBL10218105

SCHEMBL10218105

CC1CN(C(=O)c2ccc(-c3cnc(N)c(OCc4cccc(OC(F)(F)F)c4)c3)cc2)CC(C)N1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MET P08581 7/20 0.52
MAP4K4 O95819 1/20 0.48
MAP4K3 Q8IVH8 3/20 0.45
SLC6A7 Q99884 1/20 0.43
GHSR Q92847 1/20 0.41
KCNH2 Q12809 3/20 0.41
STAT3 P40763 1/20 0.40
JAK1 P23458 1/20 0.40
CYP19A1 P11511 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
SLC6A4 P31645 1/20 0.39
NTRK1 P04629 1/20 0.39

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
SCHEMBL10218088 0.91 MET (0.54) METMAP4K4MAP4K3GHSRKCNH2
SCHEMBL10218212 0.89 MAP4K4 (0.54) METMAP4K4MAP4K3
SCHEMBL30453566 0.86 MAP4K4 (0.64) METMAP4K4MAP4K3
SCHEMBL488686 0.86 MAP4K4 (0.64) METMAP4K4MAP4K3
SCHEMBL488241 0.86 MET (0.52) METMAP4K4MAP4K3
SCHEMBL10218370 0.86 MET (0.53) METMAP4K4MAP4K3
SCHEMBL10218287 0.85 MET (0.53) METMAP4K4MAP4K3KCNH2
SCHEMBL10218070 0.84 MET (0.51) METMAP4K4MAP4K3SLC6A7
SCHEMBL10218082 0.83 MET (0.62) METMAP4K4MAP4K3KCNH2
SCHEMBL10218090 0.83 MET (0.59) METMAP4K4KCNH2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106197-B2 Aminoheteroaryl compounds as protein kinase inhibitors PFIZER INC. (US) 2012-01-31 US disclosed
US-8106197-B2 Aminoheteroaryl compounds as protein kinase inhibitors PFIZER INC. (US) 2012-01-31 US disclosed
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-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-20070072874-A1 Aminoheteroaryl compounds as protein kinase inhibitors SUGEN, INC. 2007-03-29 US disclosed
US-20070072874-A1 Aminoheteroaryl compounds as protein kinase inhibitors SUGEN, INC. 2007-03-29 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-20070072874-A1 Aminoheteroaryl compounds as protein kinase inhibitors MET, MAP4K1, MAP4K2 MET 1/4885MAP4K4 10/4885MAP4K3 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.