SCHEMBL2464959

SCHEMBL2464959

O=c1c(Cc2cncc(Cl)c2)c(C2=CC=C2)[nH]c2ncnn12

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 1/20 0.31
MPO P05164 1/20 0.30
CHEK1 O14757 1/20 0.30
AURKA O14965 1/20 0.30
DAPK3 O43293 1/20 0.30
JAK2 O60674 1/20 0.30
MAP4K4 O95819 1/20 0.30
ABL1 P00519 1/20 0.30
NTRK1 P04629 1/20 0.30
LCK P06239 1/20 0.30
CSF1R P07333 1/20 0.30
RET P07949 1/20 0.30
MET P08581 1/20 0.30
PDGFRB P09619 1/20 0.30
PIM1 P11309 1/20 0.30
FGFR1 P11362 1/20 0.30
PDGFRA P16234 1/20 0.30
PRKACA P17612 1/20 0.30
FLT1 P17948 1/20 0.30
LTK P29376 1/20 0.30

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
SCHEMBL2459353 0.88 GRIN1 (0.32) ENPP1
SCHEMBL2460223 0.87 ENPP1 (0.43) ENPP1
SCHEMBL2465880 0.85 MEN1 (0.30)
SCHEMBL2457421 0.83 ALKBH3 (0.36)
SCHEMBL2454685 0.82 DAO (0.36) ENPP1KDR
SCHEMBL2456947 0.81 DAO (0.33) ENPP1
SCHEMBL2454918 0.80 PDE1B (0.34)
SCHEMBL2456758 0.80 KDM4A (0.38)
SCHEMBL2462976 0.79 DAO (0.40) ENPP1
SCHEMBL2455163 0.79 ENPP1 (0.43) ENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011114148-A1 4H- [1, 2, 4] TRIAZOLO [5, 1 -B] PYRIMIDIN-7 -ONE DERIVATIVES AS CCR2B RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2011-09-22 WO claimed
WO-2011114148-A1 4H- [1, 2, 4] TRIAZOLO [5, 1 -B] PYRIMIDIN-7 -ONE DERIVATIVES AS CCR2B RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2011-09-22 WO disclosed