SCHEMBL21167709

SCHEMBL21167709

COCCNc1cc(-c2ccc(N)c(NCc3ccc4ncccc4c3)n2)ccn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 10/20 0.42
LRRK2 Q5S007 1/20 0.42
IRAK4 Q9NWZ3 2/20 0.40
CDC7 O00311 1/20 0.38
ROCK2 O75116 1/20 0.38
PIM1 P11309 1/20 0.38
PRKACA P17612 1/20 0.38
CDK2 P24941 1/20 0.38
GSK3B P49841 1/20 0.38
CDK7 P50613 1/20 0.38
CDK9 P50750 1/20 0.38
HIPK2 Q9H2X6 1/20 0.38
WNT3A P56704 1/20 0.38
AURKA O14965 1/20 0.36
RPS6KB1 P23443 1/20 0.36
AURKB Q96GD4 1/20 0.36
NPC1 O15118 1/20 0.36
PRKCH P24723 1/20 0.36
PRKCE Q02156 1/20 0.36
KARS1 Q15046 1/20 0.36

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
SCHEMBL21167606 0.86 SYK (0.41) SYKWNT3ANPC1KDR
SCHEMBL22475849 0.83 IRAK4 (0.38) SYKLRRK2IRAK4CDC7ROCK2
SCHEMBL22475846 0.83 SYK (0.44) SYKAURKARPS6KB1KDR
SCHEMBL22475845 0.83 SYK (0.46) SYKNPC1KDR
SCHEMBL22475671 0.81 MET (0.44) SYK
SCHEMBL21167708 0.81 SYK (0.53) SYKKDR
SCHEMBL21167571 0.80 PIK3CD (0.43) SYKNPC1KDR
SCHEMBL12486928 0.77 MET (0.50) LRRK2
SCHEMBL21167474 0.77 SYK (0.48) SYKWNT3ANPC1KDR
SCHEMBL21167387 0.77 SYK (0.48) SYKWNT3ANPC1KDR

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-A1 CERTAIN TRIAZOLOPYRIDINES AND TRIAZOLOPYRIDINES, COMPOSITIONS THEREOF AND METHODS OF USE THEREFOR Hutchison Medipharma Limited (CN) 2021-03-24 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