SCHEMBL13369192

SCHEMBL13369192

COOc1ccccc1-c1ccccc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.50
HSD17B10 Q99714 5/20 0.50
HPGD P15428 4/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
ALDH1A1 P00352 4/20 0.49
ESR1 P03372 1/20 0.49
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
HMGB1 P09429 1/20 0.49
TSHR P16473 1/20 0.49
GGT1 P19440 1/20 0.49
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
BLM P54132 1/20 0.49
NAPRT Q6XQN6 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CYP2C9 P11712 2/20 0.47
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47

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
SCHEMBL536179 0.85 HTT (0.62) KDM4EHSD17B10HPGDMAPK1HTT
SCHEMBL31664325 0.85 KDM4E (0.61) KDM4EHSD17B10HPGDMAPK1HTT
SCHEMBL5459 0.85 KDM4E (0.61) KDM4EHSD17B10HPGDMAPK1HTT
SCHEMBL9634001 0.84 HTT (0.61) KDM4EHSD17B10HPGDMAPK1HTT
SCHEMBL23277174 0.83 KDM4E (0.59) KDM4EHSD17B10HPGDMAPK1HTT
Fluoride SCHEMBL28851572 0.83 KDM4E (0.59) KDM4EHSD17B10HPGDMAPK1HTT
SCHEMBL9138776 0.79 KDM4E (0.73) KDM4EHSD17B10HPGDMAPK1HTT
SCHEMBL6878826 0.78 KDM4E (0.59) KDM4EHSD17B10HPGDHTTALDH1A1
SCHEMBL36145 0.78 ALDH1A1 (0.72) KDM4EHSD17B10HPGDHTTALDH1A1
SCHEMBL30028907 0.78 ALDH1A1 (0.72) KDM4EHSD17B10HPGDHTTALDH1A1

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
US-7709550-B2 Ink composition, inkjet recording method, printed material, process for producing lithographic printing plate, and lithographic printing plate FUJIFILM CORPORATION (JP) 2010-05-04 US disclosed