SCHEMBL4857568

SCHEMBL4857568

C=C(C)N1C(=O)C=CC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.41
GSK3A P49840 2/20 0.41
GSK3B P49841 2/20 0.41
ALDH1A1 P00352 3/20 0.36
BLM P54132 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
GMNN O75496 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
THPO P40225 1/20 0.36
PMP22 Q01453 1/20 0.36
FAAH O00519 2/20 0.32
CYP1A2 P05177 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
WRN Q14191 1/20 0.31
HIF1A Q16665 1/20 0.31
HSP90AA1 P07900 2/20 0.31
CCR6 P51684 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL27722751 0.77 MGLL (0.36) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL12038009 0.77 ALDH1A1 (0.36) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL720720 0.74 MGLL (0.43) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL976025 0.72 MGLL (0.72) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL10516220 0.72 MGLL (0.35) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL18949795 0.72 MGLL (0.41) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL16609067 0.72 MGLL (0.42) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL7921542 0.70 ALDH1A1 (0.34) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL22862179 0.69 MGLL (0.33) MGLLGSK3AGSK3BALDH1A1BLM
SCHEMBL7110683 0.69 DDAH1 (0.34) MGLLGSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8741291-B2 Multifunctional antibody conjugates COVX TECHNOLOGIES IRELAND, LIMITED (IE) 2014-06-03 US disclosed
US-7320854-B2 Mixture of oxide particles, polymerizable compound,radiation sensitive decomposer and releasing agent JSR CORPORATION (JP) 2008-01-22 US disclosed
EP-1494072-A2 Radiation sensitive refractive index changing composition, pattern forming method and optical material JSR Corporation (JP) 2005-01-05 EP disclosed
US-20040265737-A1 Radiation sensitive refractive index changing composition, pattern forming method and optical material JSR CORPORATION (JP) 2004-12-30 US disclosed
EP-0800831-B9 DIAGNOSTIC MARKER DAIICHI PURE CHEMICALS CO LTD (JP) 2004-11-10 EP disclosed
EP-0800831-B1 DIAGNOSTIC MARKER DAIICHI PURE CHEMICALS CO LTD (JP) 2004-04-21 EP disclosed
US-5968479-A INDOLE, FLUORESCENT, AND CYANINE DYES; INFRARED ENDOSCOPY DAIICHI PURE CHEMICALS CO., LTD. (JP) 1999-10-19 US disclosed
EP-0800831-A1 DIAGNOSTIC MARKER DAIICHI PURE CHEMICALS CO., LTD. (JP) 1997-10-15 EP disclosed
US-4506042-A MOLDING, LAMINATION, VARISH MITSUI TOATSU CHEMICALS, INC. (JP) 1985-03-19 US disclosed