SCHEMBL5198262

SCHEMBL5198262

Fc1ccc(-c2ccc[c]c2-c2c(Cl)cccc2Cl)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.33
CYP2A6 P11509 1/20 0.33
ENPP1 P22413 1/20 0.33
MAPK1 P28482 1/20 0.33
PTGS1 P23219 1/20 0.33
RPS6KA3 P51812 2/20 0.32
DAPK3 O43293 1/20 0.32
PRKD3 O94806 1/20 0.32
MAP4K4 O95819 1/20 0.32
PAK4 O96013 1/20 0.32
ABL1 P00519 1/20 0.32
NTRK1 P04629 1/20 0.32
LCK P06239 1/20 0.32
CSF1R P07333 1/20 0.32
RET P07949 1/20 0.32
IGF1R P08069 1/20 0.32
MET P08581 1/20 0.32
PDGFRB P09619 1/20 0.32
FGFR1 P11362 1/20 0.32
PRKACA P17612 1/20 0.32

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
SCHEMBL5014600 0.81 PTGS2 (0.39) PTGS2ENPP1PTGS1RPS6KA3DAPK3
SCHEMBL2012242 0.79 MAPK1 (0.38) PTGS2MAPK1PTGS1TP53
SCHEMBL2430751 0.77 PTGS2 (0.39) PTGS2CYP2A6ENPP1PTGS1RPS6KA3
SCHEMBL9559722 0.76 PTGS2 (0.40) PTGS2PTGS1MAPK14ALDH1A1SLC6A4
SCHEMBL9559797 0.75 PTGS2 (0.39) PTGS2PTGS1MAPK14SLC6A4SLC6A3
SCHEMBL20108650 0.72 TYMP (0.42) PTGS2CYP2A6MAPK14NOS3TP53
SCHEMBL9788256 0.71 PTGS2 (0.40) PTGS2ENPP1PTGS1RPS6KA3DAPK3
SCHEMBL15635850 0.71 CYP2A6 (0.33) CYP2A6FGFR1PDK2
SCHEMBL2161599 0.70 CYP2A6 (0.65) PTGS2CYP2A6PTGS1ALDH1A1PDK2
SCHEMBL7458982 0.70 CYP2A6 (0.59) PTGS2CYP2A6MAPK1PTGS1MAPK14

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
EP-1814863-A1 INDAZOLE SULPHONAMIDE DERIVATIVES AstraZeneca AB (SE) 2007-08-08 EP disclosed
WO-2006052190-A1 INDAZOLE SULPHONAMIDE DERIVATIVES ASTRAZENECA AB (SE) 2006-05-18 WO disclosed