SCHEMBL5570747

SCHEMBL5570747

CC(=O)Nc1cccc(-c2cnc(N)c(-c3nc4cnccc4n3-c3cccc(F)c3F)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FYN P06241 2/20 0.51
USP7 Q93009 2/20 0.51
CHEK2 O96017 1/20 0.49
AKT1 P31749 8/20 0.43
AKT2 P31751 8/20 0.43
AKT3 Q9Y243 8/20 0.43
CYP2C9 P11712 5/20 0.43
NTRK1 P04629 1/20 0.42
ATR Q13535 1/20 0.42
CYP2C8 P10632 3/20 0.42
CYP2C19 P33261 1/20 0.42
PIK3C3 Q8NEB9 1/20 0.41
CYP2D6 P10635 2/20 0.40
SYK P43405 1/20 0.40
EGFR P00533 1/20 0.40
MAP4K4 O95819 1/20 0.40

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
SCHEMBL5565640 0.93 MAPK10 (0.45) FYNUSP7CHEK2AKT1AKT2
SCHEMBL13593424 0.84 FYN (0.44) FYNUSP7CHEK2AKT1AKT2
SCHEMBL5566983 0.84 AKT1 (0.46) FYNCHEK2AKT1AKT2AKT3
SCHEMBL4404047 0.82 FYN (0.57) FYNUSP7CHEK2AKT1AKT2
SCHEMBL13593438 0.79 AKT1 (0.39) AKT1AKT2AKT3
SCHEMBL986668 0.79 FYN (0.55) FYNUSP7CHEK2NTRK1ATR
SCHEMBL5565496 0.78 HRH3 (0.41) AKT1MAP4K4
SCHEMBL5570593 0.78 RPS6KA5 (0.38) FYNAKT1AKT2AKT3
SCHEMBL982314 0.77 RPS6KA5 (0.40) AKT1
SCHEMBL5570830 0.76 FYN (0.48) FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-2004625-B1 C-MET PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS VERTEX PHARMA (US) 2009-12-30 EP 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 FYN 392/4885USP7 2086/4885CHEK2 134/4885
US-20070254868-A1 C-MET protein kinase inhibitors MET, PRKCH, ABL1 FYN 392/4885USP7 2086/4885CHEK2 134/4885

“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.