SCHEMBL2930839

SCHEMBL2930839

CCOc1ccccc1C=Cc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 4/20 0.65
TRPA1 O75762 2/20 0.65
RELA Q04206 1/20 0.59
EGFR P00533 2/20 0.50
KDM4E B2RXH2 1/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49
ATM Q13315 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48
GRIN1 Q05586 1/20 0.48
GRIN2B Q13224 1/20 0.48
CYP1A1 P04798 3/20 0.47
CYP1A2 P05177 3/20 0.47
CYP1B1 Q16678 3/20 0.47
ALDH1A1 P00352 1/20 0.46
CYP19A1 P11511 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44

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
SCHEMBL2930836 1.00 NFE2L2 (0.65) NFE2L2TRPA1RELAEGFRKDM4E
SCHEMBL2622561 0.91 NFE2L2 (0.53) NFE2L2TRPA1RELAEGFRKDM4E
SCHEMBL28304597 0.88 NFE2L2 (0.54) NFE2L2TRPA1RELAKDM4EMAPT
SCHEMBL9512146 0.86 NFE2L2 (0.59) NFE2L2TRPA1RELAEGFRKDM4E
SCHEMBL5742079 0.86 NFE2L2 (0.61) NFE2L2TRPA1RELAKDM4EMAPT
SCHEMBL5742075 0.86 NFE2L2 (0.61) NFE2L2TRPA1RELAKDM4EMAPT
SCHEMBL27858101 0.84 NFE2L2 (0.64) NFE2L2TRPA1RELAKDM4EMAPT
SCHEMBL2632229 0.84 MAPT (0.54) KDM4EMAPTLMNAATMSMN1; SMN2
SCHEMBL3992904 0.83 RELA (0.47) NFE2L2TRPA1RELAEGFRKDM4E
SCHEMBL6810745 0.83 NFE2L2 (0.62) NFE2L2TRPA1RELAEGFRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109988053-A A kind of preparation method for the benzylalcohol derivative that ortho position alkenyl replaces 中国科学院化学研究所 2019-07-09 CN disclosed
EP-2231133-A2 METHOD AND COMPOSITIONS FOR ADMINISTERING RESVERATROL AND PTEROSTILBENE Rubin, David (US) 2010-09-29 EP disclosed
WO-2009089338-A2 METHOD AND COMPOSITIONS FOR ADMINISTERING RESVERATROL AND PTEROSTILBENE RUBIN DAVID (US) 2009-07-16 WO disclosed
WO-2003070849-A1 ACRYLIC PRESSURE SENSITIVE ADHESIVE FOR THE POLARIZING FILM LG CHEM, LTD. (KR) 2003-08-28 WO disclosed