SCHEMBL12538902

SCHEMBL12538902

COc1c(Cl)cc(-n2nnnc2-c2cc(-c3cnn(C4CCNCC4)c3)cnc2N)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 3/20 0.57
▸ FGFR2 P21802 3/20 0.57
▸ FGFR3 P22607 3/20 0.57
▸ MET P08581 5/20 0.49
▸ JAK2 O60674 3/20 0.49
▸ GRK2 P25098 3/20 0.48
▸ GRK5 P34947 3/20 0.48
▸ MAP4K3 Q8IVH8 7/20 0.48
▸ JAK1 P23458 2/20 0.47
▸ TYK2 P29597 2/20 0.47
▸ JAK3 P52333 2/20 0.47
▸ ALK Q9UM73 1/20 0.47
▸ FLT3 P36888 1/20 0.46
▸ KCNH2 Q12809 1/20 0.46

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
SCHEMBL12539482 0.96 FGFR1 (0.57) FGFR1FGFR2FGFR3METJAK2
SCHEMBL12538973 0.92 FGFR1 (0.54) FGFR1FGFR2FGFR3METJAK2
SCHEMBL12538901 0.90 FGFR3 (0.56) FGFR1FGFR2FGFR3METJAK2
SCHEMBL12539452 0.89 FGFR1 (0.54) FGFR1FGFR2FGFR3METJAK2
SCHEMBL12538733 0.88 FGFR1 (0.54) FGFR1FGFR2FGFR3METJAK2
SCHEMBL982736 0.85 FGFR1 (0.53) FGFR1FGFR2FGFR3METGRK2
SCHEMBL12539594 0.85 FGFR1 (0.58) FGFR1FGFR2FGFR3METJAK2
SCHEMBL12539061 0.83 FGFR3 (0.55) FGFR1FGFR2FGFR3METJAK2
SCHEMBL27900706 0.83 FGFR3 (0.55) FGFR1FGFR2FGFR3METJAK2
SCHEMBL987109 0.83 JAK2 (0.56) FGFR1FGFR2FGFR3METJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481524-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-09 — — US disclosed
US-8481524-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-09 — — US disclosed
US-20110136789-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-09 — — US disclosed
US-20110136789-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-09 — — US disclosed
EP-2205589-B1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMA (US) 2011-03-23 — — EP disclosed
WO-2009045992-A2 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-04-09 — — 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 (1 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-20110136789-A1 C-MET PROTEIN KINASE INHIBITORS MET, PRKCH, ABL1 FGFR1 133/4885FGFR2 177/4885FGFR3 153/4885

“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.

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