SCHEMBL1333813

SCHEMBL1333813

COC(=O)c1cc2c3c(ccc2cc1OCCOCCO)OC(c1ccc(OC)cc1)(c1ccc(OC)cc1)C=C3

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 3/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ACHE P22303 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
PLA2G2A P14555 3/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
PDE10A Q9Y233 1/20 0.31
HSP90AA1 P07900 2/20 0.30
EIF4A1 P60842 1/20 0.30

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
SCHEMBL1334167 0.86 PLA2G2A (0.35) HIF1AKDM4EALDH1A1LMNAMAPT
SCHEMBL7595691 0.80 HIF1A (0.34) HIF1AKDM4EALDH1A1LMNAMAPT
SCHEMBL1387468 0.78 HIF1A (0.36) HIF1AKDM4EALDH1A1ACHEPLA2G2A
SCHEMBL1387238 0.78 HIF1A (0.34) HIF1AKDM4EALDH1A1LMNAMAPT
SCHEMBL5650291 0.78 RAB9A (0.39) HIF1AKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL5667048 0.76 MAPT (0.40) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL5644893 0.76 HIF1A (0.35) HIF1AKDM4EALDH1A1HPGDACHE
SCHEMBL23800825 0.74 MTNR1A (0.33) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL1387201 0.73 POLB (0.40) HIF1AKDM4EALDH1A1MAPTHPGD
SCHEMBL5647665 0.73 KMT2A (0.35) HIF1AKDM4EALDH1A1MAPTACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6113814-A PHOTOCHROMIC; END-CAPPED WITH A POLYMERIZABLE GROUP. TRANSITIONS OPTICAL, INC. (US) 2000-09-05 US claimed
EP-2718755-B1 POLARIZING PHOTOCHROMIC ARTICLES TRANSITIONS OPTICAL INC (US) 2024-05-29 EP disclosed
US-8582192-B2 Polarizing photochromic articles TRANSITIONS OPTICAL, INC. (US) 2013-11-12 US disclosed
US-20110279883-A1 POLARIZING PHOTOCHROMIC ARTICLES TRANSITIONS OPTICAL, INC. (US) 2011-11-17 US disclosed
US-6113814-A PHOTOCHROMIC; END-CAPPED WITH A POLYMERIZABLE GROUP. TRANSITIONS OPTICAL, INC. (US) 2000-09-05 US disclosed