SCHEMBL8501229

SCHEMBL8501229

CC(C(=O)O)(c1cccc(Oc2ccc(C(=O)O)c(C(=O)O)c2)c1)C(C(=O)O)(C(=O)O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPSE Q9Y251 1/20 0.48
POLB P06746 3/20 0.48
TDP1 Q9NUW8 4/20 0.47
DUSP3 P51452 1/20 0.47
PTPN5 P54829 1/20 0.47
PTPN11 Q06124 1/20 0.47
KDM4E B2RXH2 1/20 0.44
GALK1 P51570 1/20 0.44
CASP6 P55212 1/20 0.44
MCL1 Q07820 1/20 0.44
PLEC Q15149 1/20 0.44
ALDH1A1 P00352 1/20 0.43
NPC1 O15118 1/20 0.42
CYP2C9 P11712 1/20 0.42
RAB9A P51151 1/20 0.42
PYGM P11217 3/20 0.41
MAPK1 P28482 1/20 0.40
GFER P55789 1/20 0.40
LMNA P02545 1/20 0.39
KMO O15229 1/20 0.39

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
SCHEMBL8504279 0.88 POLB (0.51) HPSEPOLBTDP1DUSP3PTPN5
SCHEMBL1099667 0.85 POLB (0.54) HPSEPOLBTDP1DUSP3PTPN5
SCHEMBL29907832 0.85 POLB (0.54) HPSEPOLBTDP1DUSP3PTPN5
SCHEMBL16666243 0.82 POLB (0.51) HPSEPOLBTDP1DUSP3PTPN5
SCHEMBL4331166 0.80 HPSE (0.46) HPSEPOLBTDP1DUSP3PTPN5
SCHEMBL7637726 0.78 POLB (0.67) HPSEPOLBTDP1DUSP3PTPN5
SCHEMBL29393214 0.78 POLB (0.67) HPSEPOLBTDP1DUSP3PTPN5
SCHEMBL140780 0.78 POLB (0.67) HPSEPOLBTDP1DUSP3PTPN5
SCHEMBL29779713 0.77 POLB (0.51) HPSEPOLBTDP1DUSP3PTPN5
SCHEMBL1100529 0.77 POLB (0.51) HPSEPOLBTDP1DUSP3PTPN5

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-5928733-A Active-matrix liquid crystal display HITACHI, LTD. (JP) 1999-07-27 US disclosed