SCHEMBL1582209

SCHEMBL1582209

C[C@@H](Oc1cc(-c2cnn(C3CCNCC3)c2)cnc1N)c1c(F)ccc(F)c1Cl

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 11/20 0.90
▸ JAK2 O60674 7/20 0.90
▸ MAP4K3 Q8IVH8 7/20 0.90
▸ ALK Q9UM73 6/20 0.90
▸ JAK3 P52333 4/20 0.90
▸ JAK1 P23458 3/20 0.90
▸ TYK2 P29597 3/20 0.90
▸ PLK4 O00444 2/20 0.90
▸ AURKA O14965 2/20 0.90
▸ DCLK1 O15075 2/20 0.90
▸ PRKD3 O94806 2/20 0.90
▸ ABL1 P00519 2/20 0.90
▸ NTRK1 P04629 2/20 0.90
▸ INSR P06213 2/20 0.90
▸ LCK P06239 2/20 0.90
▸ FES P07332 2/20 0.90
▸ CSF1R P07333 2/20 0.90
▸ LYN P07948 2/20 0.90
▸ RET P07949 2/20 0.90
▸ IGF1R P08069 2/20 0.90

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
SCHEMBL3243547 1.00 MET (0.90) METJAK2MAP4K3ALKJAK3
Acetic Acid SCHEMBL16324188 0.95 MET (0.82) METJAK2MAP4K3ALKJAK3
Crizotinib SCHEMBL28844303 0.95 MET (1.00) METJAK2MAP4K3ALKJAK3
Crizotinib SCHEMBL30129754 0.95 MET (1.00) METJAK2MAP4K3ALKJAK3
Crizotinib SCHEMBL94020 0.95 MET (1.00) METJAK2MAP4K3ALKJAK3
Crizotinib SCHEMBL29831970 0.95 MET (1.00) METJAK2MAP4K3ALKJAK3
Crizotinib SCHEMBL28844302 0.95 MET (1.00) METJAK2MAP4K3ALKJAK3
Crizotinib SCHEMBL29351506 0.95 MET (1.00) METJAK2MAP4K3ALKJAK3
Crizotinib SCHEMBL93829 0.95 MET (1.00) METJAK2MAP4K3ALKJAK3
Crizotinib SCHEMBL29622387 0.95 MET (1.00) METJAK2MAP4K3ALKJAK3

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140288086-A1 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS PFIZER INC. (US) 2014-09-25 — — US claimed
EP-1786785-B9 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS PFIZER (US) 2013-05-22 — — EP claimed
US-20120263706-A1 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS AGOURON PHARMACEUTICALS, INC. 2012-10-18 — — US claimed
US-20100324061-A1 including crizotinib which is 3-[(R)-1-(2-chloro-3,6-difluoro-phenyl)-ethoxy]-5-(1-piperidin-4-yl-1H-pyrazol-4-yl)-pyridin-2-ylamine; c-met inhibitors; hepatocyte growth factor (HGF) receptor (c-MET) receptor tyrosine kinase (RTK) AGOURON PHARMACEUTICALS, INC. 2010-12-23 — — US claimed
EP-1786785-B1 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS PFIZER (US) 2010-04-07 — — EP claimed
EP-1786785-A2 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS Pfizer, Inc. (US) 2007-05-23 — — EP claimed
US-20060046991-A1 Crizotinib, a c-Met protein kinase inhibitor anticancer agent; 3-[(R)-1-(2,6-dichloro-3-fluoro-phenyl)-ethoxy]-5-(1-piperidin-4-yl-1H-pyrazol-4-yl)-pyridin-2-ylamine is crizotinib AGOURON PHARMACEUTICALS, INC. 2006-03-02 — — US claimed
WO-2006021884-A2 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS PFIZER INC. (US) 2006-03-02 — — WO claimed
EP-2315601-B1 COMBINATION OF A C-MET ANTAGONIST AND AN AMINOHETEROARYL COMPOUND FOR THE TREATMENT OF CANCER PF MEDICAMENT (FR) 2018-02-14 — — EP disclosed
US-9375425-B2 Combination of a C-Met antagonist and an aminoheteroaryl compound for the treatment of cancer PIERRE FABRE MEDICAMENT (FR) 2016-06-28 — — US disclosed
US-20150250780-A1 COMBINATION OF A C-MET ANTAGONIST AND AN AMINOHETEROARYL COMPOUND FOR THE TREATMENT OF CANCER PIERRE FABRE MEDICAMENT (FR) 2015-09-10 — — US disclosed
US-9011865-B2 Combination of a c-Met antagonist and an aminoheteroaryl compound for the treatment of cancer Pierre Gabre Medicament (FR) 2015-04-21 — — US disclosed
WO-2014203177-A1 AMORPHOUS (R) -3- [1- (2, 6-DICHLORO-3-FLUOROPHENYL) METHOXY] -5- [1- (PIPERIDIN-4- YL) -1H-PYRAZOL-4-YL] PYRIDIN-2-AMINE SHILPA MEDICARE LIMITED (IN) 2014-12-24 — — WO disclosed
US-20140288086-A1 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS PFIZER INC. (US) 2014-09-25 — — US disclosed
EP-1784396-A2 PYRAZOLE-SUBSTITUTED AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS Pfizer, Inc. (US) 2007-05-16 — — EP disclosed
US-20060276450-A1 Isoquinoline potassium channel inhibitors MERCK SHARP & DOHME CORP. 2006-12-07 — — US disclosed
US-20060128724-A1 Pyrazole-substituted aminoheteroaryl compounds as protein kinase inhibitors AGOURON PHARMACEUTICALS, INC. 2006-06-15 — — US disclosed
US-20060046991-A1 Crizotinib, a c-Met protein kinase inhibitor anticancer agent; 3-[(R)-1-(2,6-dichloro-3-fluoro-phenyl)-ethoxy]-5-(1-piperidin-4-yl-1H-pyrazol-4-yl)-pyridin-2-ylamine is crizotinib AGOURON PHARMACEUTICALS, INC. 2006-03-02 — — US disclosed
WO-2006021884-A2 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS PFIZER INC. (US) 2006-03-02 — — WO disclosed
WO-2006021881-A2 PYRAZOLE-SUBSTITUTED AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS PFIZER INC. (US) 2006-03-02 — — 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 (7 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-20060276450-A1 Isoquinoline potassium channel inhibitors KCNQ1, KCNQ2, KCNJ2 MET 4877/4885JAK2 3605/4885MAP4K3 407/4885
US-20060128724-A1 Pyrazole-substituted aminoheteroaryl compounds as protein kinase inhibitors MET, MAP3K15, MAP3K19 MET 1/4885JAK2 249/4885MAP4K3 10/4885
US-20060046991-A1 Crizotinib, a c-Met protein kinase inhibitor anticancer agent; 3-[(R)-1-(2,6-dichloro-3-fluoro-phenyl)-ethoxy]-5-(1-piperidin-4-yl-1H-pyrazol-4-yl)-pyridin-2-ylamine is crizotinib ALK, MET, ERBB2 MET 2/4885JAK2 192/4885MAP4K3 78/4885
US-20100324061-A1 including crizotinib which is 3-[(R)-1-(2-chloro-3,6-difluoro-phenyl)-ethoxy]-5-(1-piperidin-4-yl-1H-pyrazol-4-yl)-pyridin-2-ylamine; c-met inhibitors; hepatocyte growth factor (HGF) receptor (c-MET) receptor tyrosine kinase (RTK) MET, HGF, ALK MET 1/4885JAK2 97/4885MAP4K3 147/4885
US-20120263706-A1 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS MET, MAP3K15, MAP3K1 MET 1/4885JAK2 350/4885MAP4K3 24/4885
US-20150250780-A1 COMBINATION OF A C-MET ANTAGONIST AND AN AMINOHETEROARYL COMPOUND FOR THE TREATMENT OF CANCER MET, HGF, EGFR MET 1/4885JAK2 330/4885MAP4K3 1607/4885
US-20140288086-A1 ENANTIOMERICALLY PURE AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS MET, MAP3K15, MAP3K1 MET 1/4885JAK2 350/4885MAP4K3 24/4885

“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.

Send feedback