SCHEMBL488524

SCHEMBL488524

CC(Oc1nc(-c2ccc(NS(=O)(=O)CCN(C)C)cc2)cnc1N)c1c(F)ccc(F)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MET P08581 11/20 0.45
MAP4K3 Q8IVH8 1/20 0.43
ALK Q9UM73 3/20 0.40
ROS1 P08922 1/20 0.40
CHEK2 O96017 1/20 0.37
SGK1 O00141 4/20 0.36
ACVR1 Q04771 1/20 0.35
CYP3A4 P08684 1/20 0.34
SGK3 Q96BR1 1/20 0.34
SGK2 Q9HBY8 1/20 0.34

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
SCHEMBL30453613 1.00 MET (0.45) METMAP4K3ALKROS1CHEK2
SCHEMBL30453170 0.95 MET (0.51) METMAP4K3ALKROS1
SCHEMBL488256 0.95 MET (0.51) METMAP4K3ALKROS1
SCHEMBL30453554 0.92 MET (0.44) METMAP4K3ALKROS1CHEK2
SCHEMBL488469 0.92 MET (0.44) METMAP4K3ALKROS1CHEK2
SCHEMBL488429 0.87 MET (0.49) METMAP4K3ALKROS1
SCHEMBL30453563 0.87 MET (0.49) METMAP4K3ALKROS1
SCHEMBL487801 0.86 MET (0.51) METMAP4K3ALKCHEK2SGK1
SCHEMBL488603 0.86 MET (0.51) METMAP4K3ALKCHEK2
SCHEMBL488303 0.86 MAP4K3 (0.47) METMAP4K3ALKCHEK2SGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4695588-B2 2011-06-08 JP claimed
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-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 1/4885MAP4K3 8/4885ALK 138/4885

“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.