SCHEMBL21167397

SCHEMBL21167397

CNCCCn1cc(-c2ccc(N)c(NCc3ccc4ncccc4c3)n2)cn1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.46
CYP2C9 P11712 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
PDE10A Q9Y233 1/20 0.42
SYK P43405 1/20 0.39

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
SCHEMBL21167610 0.90 MET (0.54) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL21167616 0.88 MET (0.55) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL23127852 0.88 MET (0.44) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL21167414 0.88 MET (0.53) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL22475671 0.87 MET (0.44) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL22475958 0.84 MET (0.42) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL21167534 0.84 MET (0.42) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL21167428 0.83 MET (0.44) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL21167608 0.83 MET (0.41) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL21167714 0.81 MET (0.44) METSYK

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