SCHEMBL22475845

SCHEMBL22475845

COCCOc1ccc(-c2ccc(N)c(NCc3ccc4ncccc4c3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 11/20 0.46
PDPK1 O15530 1/20 0.38
KDR P35968 2/20 0.38
HDAC1 Q13547 1/20 0.38
CLK1 P49759 2/20 0.38
CLK2 P49760 2/20 0.38
DYRK1A Q13627 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
DYRK1B Q9Y463 2/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.37
MET P08581 1/20 0.37

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
SCHEMBL22475846 0.91 SYK (0.44) SYKPDPK1KDRHDAC1CLK1
SCHEMBL21167571 0.88 PIK3CD (0.43) SYKPDPK1KDRHDAC1CLK1
SCHEMBL21167606 0.87 SYK (0.41) SYKKDRNPC1
SCHEMBL21167708 0.83 SYK (0.53) SYKKDRCLK1DYRK1ACLK4
SCHEMBL21167709 0.83 SYK (0.42) SYKKDRNPC1
SCHEMBL21167474 0.81 SYK (0.48) SYKKDRHDAC1NPC1MET
SCHEMBL22475671 0.81 MET (0.44) SYKMET
SCHEMBL19961116 0.81 SYK (0.46) SYKPDPK1KDRNPC1MET
SCHEMBL21167464 0.81 NPC1 (0.36) SYKPDPK1KDRCLK1CLK2
SCHEMBL22754358 0.81 SYK (0.47) SYKKDRDYRK1ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3511330-B1 SYNTHETIC INTERMEDIATE USEFUL IN THE PREPARATION OF TRIAZOLOPYRIDINE C-MET INHIBITORS HUTCHISON MEDIPHARMA LTD (CN) 2020-09-30 EP disclosed