SCHEMBL986847

SCHEMBL986847

COc1c(F)cccc1-n1nnnc1-c1cc(-c2cnn(C3CCNCC3)c2)cnc1N

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.52
FGFR2 P21802 3/20 0.52
FGFR3 P22607 3/20 0.52
ALK Q9UM73 1/20 0.50
MAP4K3 Q8IVH8 5/20 0.49
GRK2 P25098 2/20 0.49
GRK5 P34947 2/20 0.49
MET P08581 4/20 0.48
JAK2 O60674 4/20 0.48
JAK1 P23458 2/20 0.48
TYK2 P29597 2/20 0.48
JAK3 P52333 2/20 0.48
KCNH2 Q12809 2/20 0.47
SIK1 P57059 1/20 0.47
SIK3 Q9Y2K2 1/20 0.47

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
SCHEMBL985969 0.90 GRK5 (0.52) FGFR1FGFR2FGFR3ALKMAP4K3
SCHEMBL28802167 0.89 MAP4K3 (0.55) FGFR1FGFR2FGFR3ALKMAP4K3
SCHEMBL986508 0.88 MAP4K3 (0.53) FGFR1FGFR3ALKMAP4K3GRK2
SCHEMBL983243 0.87 GRK5 (0.54) FGFR1FGFR2FGFR3ALKMAP4K3
SCHEMBL986964 0.87 GRK5 (0.49) FGFR1FGFR2FGFR3ALKMAP4K3
SCHEMBL12539055 0.87 FGFR1 (0.57) FGFR1FGFR2FGFR3ALKMAP4K3
SCHEMBL988282 0.86 JAK2 (0.59) FGFR1FGFR2FGFR3ALKMAP4K3
SCHEMBL1425297 0.85 JAK2 (0.54) FGFR1FGFR2FGFR3ALKMAP4K3
SCHEMBL985759 0.85 JAK2 (0.52) ALKMAP4K3GRK2GRK5MET
SCHEMBL984834 0.85 GRK5 (0.47) FGFR1FGFR2FGFR3ALKMAP4K3

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
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
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 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.