SCHEMBL6443205

SCHEMBL6443205

CSc1nccc(C(C=O)c2cccc(O)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 1/20 0.34
MAPK10 P53779 1/20 0.34
GAA P10253 3/20 0.33
MAPT P10636 1/20 0.33
HIF1A Q16665 4/20 0.33
LMNA P02545 3/20 0.33
ADRB1 P08588 2/20 0.33
ADRA1A P35348 2/20 0.33
GALR3 O60755 1/20 0.33
MIF P14174 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2B P41595 1/20 0.33
OPRK1 P41145 2/20 0.32
MAPKAPK2 P49137 1/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
KMT2A Q03164 1/20 0.32
ADRB2 P07550 1/20 0.31
HTR1A P08908 1/20 0.31

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
SCHEMBL6024760 0.85 MAPK9 (0.34) MAPK9MAPK10GAALMNARAB9A
SCHEMBL6024314 0.85 MAPK9 (0.34) MAPK9MAPK10GAAMAPTLMNA
SCHEMBL6025036 0.85 GAA (0.38) MAPK9MAPK10GAALMNARAB9A
SCHEMBL7253009 0.84 MEN1 (0.41) MAPK9MAPK10GAAMAPTLMNA
SCHEMBL5753432 0.82 PNMT (0.36) GAALMNA
SCHEMBL5745770 0.80 SMN1; SMN2 (0.45) LMNAMEN1KMT2ATSHRHTT
SCHEMBL6441296 0.78 ALDH1A1 (0.40) MAPK9MAPK10GAAADRB1RAB9A
SCHEMBL5746437 0.78 TLR4 (0.41) MAPTMEN1KMT2AHTR1AKDM4E
SCHEMBL5764702 0.78 MAPK9 (0.38) MAPK9MAPK10GAALMNARAB9A
SCHEMBL6443197 0.78 CNR1 (0.43) GAAHIF1AMEN1KMT2AHTT

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-1499577-A1 2-(2,6-DICHLOROPHENYL)-DIARYLIMIDAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2005-01-26 EP disclosed
WO-2003087026-A1 2-(2,6-DICHLOROPHENYL)-DIARYLIMIDAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2003-10-23 WO disclosed