SCHEMBL982736

SCHEMBL982736

Nc1ncc(-c2cnn(C3CCNCC3)c2)cc1-c1nnnn1-c1cc(F)cc(F)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.53
FGFR2 P21802 2/20 0.53
FGFR3 P22607 2/20 0.53
GRK5 P34947 7/20 0.53
GRK2 P25098 6/20 0.53
MET P08581 9/20 0.51
ALK Q9UM73 1/20 0.51
KCNH2 Q12809 2/20 0.50
MAP4K3 Q8IVH8 5/20 0.49
FLT3 P36888 2/20 0.49
NTRK1 P04629 1/20 0.48

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
SCHEMBL12538973 0.88 FGFR1 (0.54) FGFR1FGFR2FGFR3GRK5GRK2
SCHEMBL983243 0.88 GRK5 (0.54) FGFR1FGFR2FGFR3GRK5GRK2
SCHEMBL12538936 0.87 FGFR1 (0.54) FGFR1FGFR2FGFR3GRK5GRK2
SCHEMBL986491 0.87 NTRK1 (0.54) FGFR1FGFR2FGFR3GRK5GRK2
SCHEMBL986648 0.86 MET (0.53) FGFR1FGFR2FGFR3GRK5GRK2
SCHEMBL12539395 0.86 FGFR1 (0.56) FGFR1FGFR2FGFR3GRK5GRK2
SCHEMBL12539452 0.85 FGFR1 (0.54) FGFR1FGFR2FGFR3GRK5GRK2
SCHEMBL986517 0.85 ALK (0.56) FGFR1FGFR3GRK5GRK2MET
SCHEMBL12538902 0.85 FGFR1 (0.57) FGFR1FGFR2FGFR3GRK5GRK2
SCHEMBL12538817 0.85 FGFR1 (0.59) FGFR1FGFR2FGFR3GRK5GRK2

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 15 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
US-8232406-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-31 US claimed
US-20110059936-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-10 US claimed
US-7872031-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-01-18 US 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
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

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 FGFR1 285/4885FGFR2 323/4885FGFR3 249/4885
US-20070254868-A1 C-MET protein kinase inhibitors MET, PRKCH, ABL1 FGFR1 285/4885FGFR2 323/4885FGFR3 249/4885

“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.