SCHEMBL986488

SCHEMBL986488

Nc1ncc(-c2cnn(CC3CCNC3)c2)cc1-c1nnnn1-c1cccc(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MET P08581 5/20 0.40
BMPR1A P36894 2/20 0.38
ACVRL1 P37023 2/20 0.38
ACVR1 Q04771 2/20 0.38
GRK2 P25098 2/20 0.36
GRK5 P34947 2/20 0.36
ALK Q9UM73 1/20 0.36
KCNN4 O15554 2/20 0.36
AXL P30530 2/20 0.34
MERTK Q12866 1/20 0.34
KCNH2 Q12809 2/20 0.34
PIM1 P11309 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
LRRK2 Q5S007 1/20 0.34
MAP4K3 Q8IVH8 2/20 0.33
MELK Q14680 1/20 0.33
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR3 P22607 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
SCHEMBL12924161 0.95 BMPR1A (0.43) METBMPR1AACVRL1ACVR1GRK2
SCHEMBL984510 0.95 BMPR1A (0.40) METBMPR1AACVRL1ACVR1GRK2
SCHEMBL12924158 0.94 MET (0.45) METBMPR1AACVRL1ACVR1GRK2
SCHEMBL986314 0.86 JAK2 (0.34) METGRK2GRK5ALKKCNN4
SCHEMBL986316 0.86 JAK2 (0.34) METGRK2GRK5ALKKCNN4
SCHEMBL985847 0.85 GRK5 (0.47) METGRK2GRK5ALKKCNH2
SCHEMBL984830 0.85 GRK5 (0.47) METGRK2GRK5ALKKCNH2
SCHEMBL984834 0.85 GRK5 (0.47) METGRK2GRK5ALKKCNH2
SCHEMBL985969 0.83 GRK5 (0.52) METGRK2GRK5ALKKCNH2
SCHEMBL986886 0.82 MET (0.47) METBMPR1AACVRL1ACVR1GRK2

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 MET 1/4885BMPR1A 1567/4885ACVRL1 1148/4885
US-20070254868-A1 C-MET protein kinase inhibitors MET, PRKCH, ABL1 MET 1/4885BMPR1A 1567/4885ACVRL1 1148/4885

“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.