SCHEMBL2360979

SCHEMBL2360979

O=C(O)c1c[nH]c(-c2c(F)cccc2Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGES O14684 14/20 0.43
JAK2 O60674 2/20 0.43
TTR P02766 1/20 0.41
JAK3 P52333 1/20 0.39
EIF4E P06730 1/20 0.39
DHODH Q02127 1/20 0.39
KMO O15229 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
ACMSD Q8TDX5 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL14692526 0.83 KMO (0.38) EIF4EDHODHKMO
SCHEMBL3795491 0.82 PTGES (0.43) PTGESJAK2TTREIF4EDHODH
SCHEMBL4783219 0.79 TTR (0.55) PTGESJAK2TTREIF4EDHODH
SCHEMBL4786153 0.77 EIF4E (0.50) PTGESTTREIF4EDHODHKMO
SCHEMBL28775125 0.76 ALPL (0.44) PTGESKDM4ETDP1
SCHEMBL3801465 0.76 ALOX15 (0.36) PTGESJAK2KDM4EALOX15TSHR
SCHEMBL2574268 0.75 PTGES (0.44) PTGESJAK2JAK3
SCHEMBL3800201 0.75 PTGES (0.43) PTGES
SCHEMBL3800584 0.74 PTGES (0.44) PTGESALOX15
SCHEMBL3799835 0.74 PTGES (0.45) PTGESJAK2JAK3

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-2011099832-A2 NOVEL BENZIMIDAZOLE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CRYSTALGENOMICS, INC. (KR) 2011-08-18 WO disclosed
WO-2010127152-A2 COMPOUNDS AND COMPOSITIONS AS MICROSOMAL PROSTAGLANDIN E SYNTHASE-1 INHIBITORS IRM LLC (BM) 2010-11-04 WO disclosed