SCHEMBL21167343

SCHEMBL21167343

Nc1ncc(-c2cnn(CCO)c2)nc1N(N)Cc1csc2ncccc12

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 0.44
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
CYP2C9 P11712 1/20 0.37
PDE10A Q9Y233 1/20 0.37
FEN1 P39748 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
KDR P35968 1/20 0.35
KIT P10721 1/20 0.35
EGFR P00533 1/20 0.35

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
SCHEMBL21167378 0.90 MET (0.40) METJAK2JAK1TYK2JAK3
SCHEMBL21167774 0.90 MET (0.45) METJAK2JAK1TYK2JAK3
SCHEMBL22475785 0.88 MET (0.56) METKDR
SCHEMBL21167541 0.83 MET (0.44) METKDR
SCHEMBL21167339 0.82 MET (0.43) METJAK2JAK1TYK2JAK3
SCHEMBL14378441 0.79 MET (0.59) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL21167577 0.77 MET (0.52) METPDE3BPDE3A
SCHEMBL23128022 0.76 MET (0.46) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL21167690 0.76 MET (0.41) METPDE3BPDE3ACYP2C9PDE10A
SCHEMBL23128151 0.74 MET (0.39) METPDE3BPDE3ACYP2C9PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3795573-B1 CERTAIN TRIAZOLOPYRAZINES, COMPOSITIONS THEREOF AND METHODS OF USE THEREFOR HUTCHISON MEDIPHARMA LTD (CN) 2022-07-06 EP disclosed
EP-3511330-B1 SYNTHETIC INTERMEDIATE USEFUL IN THE PREPARATION OF TRIAZOLOPYRIDINE C-MET INHIBITORS HUTCHISON MEDIPHARMA LTD (CN) 2020-09-30 EP disclosed
EP-3511330-A1 SYNTHETIC INTERMEDIATE USEFUL IN THE PREPARATION OF TRIAZOLOPYRIDINE C-MET INHIBITORS Hutchison Medipharma Limited (CN) 2019-07-17 EP disclosed