SCHEMBL2930006

SCHEMBL2930006

CC(C=CC(=O)OC(C)COc1ccc(C(=O)c2ccccc2)c(O)c1)COc1ccc(C(=O)c2ccccc2)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.50
LMNA P02545 5/20 0.50
ALDH1A1 P00352 3/20 0.50
MAPK1 P28482 3/20 0.50
CYP1A2 P05177 2/20 0.50
PGR P06401 2/20 0.50
SLC6A2 P23975 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP2D6 P10635 1/20 0.50
PDE4A P27815 1/20 0.50
HRH1 P35367 1/20 0.50
HTT P42858 1/20 0.50
SLC6A3 Q01959 1/20 0.50
PDE4D Q08499 1/20 0.50
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43

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
SCHEMBL2775710 0.86 HPGD (0.53) HPGDLMNAALDH1A1MAPK1CYP1A2
SCHEMBL8927808 0.81 HPGD (0.58) HPGDLMNAALDH1A1MAPK1CYP1A2
SCHEMBL10573657 0.80 HPGD (0.53) HPGDLMNAALDH1A1MAPK1CYP1A2
SCHEMBL10573662 0.80 HPGD (0.53) HPGDLMNAALDH1A1MAPK1CYP1A2
SCHEMBL3359451 0.80 HPGD (0.53) HPGDLMNAALDH1A1MAPK1CYP1A2
SCHEMBL24376194 0.79 HPGD (0.65) HPGDLMNAALDH1A1MAPK1CYP1A2
SCHEMBL29969473 0.79 HPGD (0.65) HPGDLMNAALDH1A1MAPK1CYP1A2
SCHEMBL6545279 0.78 HPGD (0.63) HPGDLMNAALDH1A1MAPK1CYP1A2
SCHEMBL11599955 0.77 HPGD (0.62) HPGDLMNAALDH1A1MAPK1CYP1A2
SCHEMBL17409253 0.76 HPGD (0.62) HPGDLMNAALDH1A1MAPK1CYP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1931621-B1 COMPOUNDS SUITABLE AS POLYMERIZABLE YELLOW DYES; POLYMERIZABLE AND/OR CROSSLINKABLE COMPOSITIONS, POLYMER MATRICES AND INTRAOCULAR LENSES CONTAINING SAME CORNEAL INNOVATION (FR) 2010-08-04 EP disclosed
EP-1931621-A2 COMPOUNDS SUITABLE AS POLYMERIZABLE YELLOW DYES; POLYMERIZABLE AND/OR CROOSLINKABLE COMPOSITIONS, POLYMER MATRICES AND INTRAOCULAR LENSES CONTAINING SAME Corneal Industrie (FR) 2008-06-18 EP disclosed
WO-2007036672-A2 COMPOUNDS SUITABLE AS POLYMERIZABLE YELLOW DYES; POLYMERIZABLE AND/OR CROOSLINKABLE COMPOSITIONS, POLYMER MATRICES AND INTRAOCULAR LENSES CONTAINING SAME CORNEAL INNOVATION (FR) 2007-04-05 WO disclosed