SCHEMBL4408337

SCHEMBL4408337

Nc1ncc(-c2ccccc2O)cc1-c1nncn1-c1cccc(Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 2/20 0.46
P2RX7 Q99572 9/20 0.39
MAP4K4 O95819 2/20 0.38
SMARCA2 P51531 2/20 0.37
SMARCA4 P51532 2/20 0.37
BRD4 O60885 1/20 0.37
NR1I2 O75469 1/20 0.37
PBRM1 Q86U86 1/20 0.37
ALDH1A1 P00352 1/20 0.36
PIK3CA P42336 1/20 0.34
PIK3C3 Q8NEB9 1/20 0.34
FYN P06241 1/20 0.33
CHRNA7 P36544 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
SCHEMBL4409477 0.87 MAP4K4 (0.47) USP7P2RX7MAP4K4ALDH1A1FYN
SCHEMBL4405450 0.83 P2RX7 (0.41) USP7P2RX7MAP4K4PIK3CAFYN
SCHEMBL4409366 0.83 MAP4K4 (0.44) USP7P2RX7MAP4K4FYN
SCHEMBL4404714 0.82 FYN (0.45) USP7P2RX7MAP4K4FYNCHRNA7
SCHEMBL4408459 0.81 P2RX7 (0.48) P2RX7ALDH1A1
SCHEMBL985033 0.81 P2RX7 (0.40) USP7P2RX7ALDH1A1PIK3CA
SCHEMBL4407376 0.80 FYN (0.46) USP7MAP4K4PIK3C3FYNCHRNA7
SCHEMBL4414034 0.80 FYN (0.41) USP7P2RX7MAP4K4FYN
SCHEMBL4408219 0.80 FYN (0.45) P2RX7MAP4K4FYNCHRNA7
SCHEMBL982271 0.79 P2RX7 (0.49) P2RX7ALDH1A1

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 USP7 2086/4885P2RX7 3624/4885MAP4K4 150/4885
US-20070254868-A1 C-MET protein kinase inhibitors MET, PRKCH, ABL1 USP7 2086/4885P2RX7 3624/4885MAP4K4 150/4885

“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.