SCHEMBL8002383

SCHEMBL8002383

CC=CC(=O)OCC(O)Cc1ccc(C(=O)c2ccccc2)c(O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.43
LMNA P02545 2/20 0.43
CYP1A2 P05177 2/20 0.43
ALDH1A1 P00352 1/20 0.43
PGR P06401 1/20 0.43
CYP2D6 P10635 1/20 0.43
SLC6A2 P23975 1/20 0.43
PDE4A P27815 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.43
HRH1 P35367 1/20 0.43
HTT P42858 1/20 0.43
SLC6A3 Q01959 1/20 0.43
PDE4D Q08499 1/20 0.43
GAA P10253 3/20 0.42
USP2 O75604 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42

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
SCHEMBL7999286 0.91 MMP1 (0.39) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL23839109 0.87 GAA (0.44) HPGDLMNACYP1A2ALDH1A1PGR
SCHEMBL93302 0.84 HPGD (0.54) HPGDLMNACYP1A2ALDH1A1PGR
SCHEMBL8002380 0.81 LMNA (0.44) HPGDLMNACYP1A2ALDH1A1PGR
SCHEMBL6854428 0.81 MEN1 (0.58) HPGDLMNACYP1A2ALDH1A1PGR
SCHEMBL27618708 0.79 LMNA (0.53) HPGDLMNACYP1A2ALDH1A1PGR
SCHEMBL8649545 0.78 LMNA (0.45) HPGDLMNACYP1A2ALDH1A1PGR
SCHEMBL5276524 0.77 CA12 (0.44) AKR1B1
SCHEMBL226212 0.76 NPC1 (0.35) HPGDLMNACYP1A2ALDH1A1GAA
SCHEMBL93361 0.75 LMNA (0.51) HPGDLMNACYP1A2ALDH1A1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170038605-A1 OPHTHALMIC EYEWEAR FOR REGULATING OCULAR EXPOSURE TO HIGH ENERGY ELECTROMAGNETIC RADIATION JEROME LEGERTON A (US) 2017-02-09 US disclosed
EP-0972223-A4 LIGHT FILTERING CONTACT LENS PARAGON VISION SCIENCES INC (US) 2000-07-19 EP disclosed
EP-0972223-A1 LIGHT FILTERING CONTACT LENS PARAGON VISION SCIENCES, INC. (US) 2000-01-19 EP disclosed
US-5846457-A Light filtering contact lens method SPORTSIGHT, LLC 1998-12-08 US disclosed
WO-1998044380-A1 LIGHT FILTERING CONTACT LENS PARAGON VISION SCIENCES, INC. (US) 1998-10-08 WO disclosed
US-5617154-A Light filtering contact lens FLEXLENS (US) 1997-04-01 US disclosed