SCHEMBL4409477

SCHEMBL4409477

Nc1ncc(-c2ccccc2)cc1-c1nncn1-c1cccc(Cl)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 5/20 0.47
USP7 Q93009 2/20 0.41
P2RX7 Q99572 5/20 0.41
MKNK1 Q9BUB5 2/20 0.39
CHEK2 O96017 1/20 0.39
FYN P06241 2/20 0.38
PDPK1 O15530 1/20 0.37
CDK1 P06493 1/20 0.37
CDK2 P24941 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
ALDH1A1 P00352 1/20 0.36
OPRD1 P41143 1/20 0.36
LRRK2 Q5S007 1/20 0.36

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
SCHEMBL4409366 0.91 MAP4K4 (0.44) MAP4K4USP7P2RX7FYN
SCHEMBL4405450 0.91 P2RX7 (0.41) MAP4K4USP7P2RX7CHEK2FYN
SCHEMBL4408219 0.88 FYN (0.45) MAP4K4P2RX7CHEK2FYN
SCHEMBL4414034 0.88 FYN (0.41) MAP4K4USP7P2RX7FYNLRRK2
SCHEMBL4404714 0.88 FYN (0.45) MAP4K4USP7P2RX7FYN
SCHEMBL4408337 0.87 USP7 (0.46) MAP4K4USP7P2RX7FYNALDH1A1
SCHEMBL4408459 0.86 P2RX7 (0.48) P2RX7CHEK2ALDH1A1
SCHEMBL985033 0.84 P2RX7 (0.40) USP7P2RX7ALDH1A1
SCHEMBL4405752 0.84 FYN (0.50) CHEK2FYN
SCHEMBL4407376 0.84 FYN (0.46) MAP4K4USP7CHEK2FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101479255-B C-MET protein kinase inhibitors for the treatment of proliferative disorders VERTEX PHARMA 2013-05-01 CN claimed
EP-2004625-B1 C-MET PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS VERTEX PHARMA (US) 2009-12-30 EP claimed
US-20070254868-A1 C-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-11-01 US claimed
US-8232406-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-31 US disclosed
US-8232406-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-31 US disclosed
US-20110059936-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-10 US disclosed
US-20110059936-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-10 US disclosed
US-7872031-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-01-18 US disclosed
US-7872031-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-01-18 US disclosed
US-20070254868-A1 C-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-11-01 US disclosed
US-20070254868-A1 C-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-11-01 US disclosed
WO-2007111904-A2 C-MET PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-10-04 WO 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 (2 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-20110059936-A1 C-MET PROTEIN KINASE INHIBITORS MET, PRKCH, ABL1 MAP4K4 150/4885USP7 2086/4885P2RX7 3624/4885
US-20070254868-A1 C-MET protein kinase inhibitors MET, PRKCH, ABL1 MAP4K4 150/4885USP7 2086/4885P2RX7 3624/4885

“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.