SCHEMBL4423833

SCHEMBL4423833

CC(=CCCCCCCCCC#N)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.40
TBXAS1 P24557 1/20 0.37
CD81 P60033 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PPARG P37231 1/20 0.33
TSHR P16473 1/20 0.32
HIF1A Q16665 1/20 0.31
EPAS1 Q99814 1/20 0.31
HMGCR P04035 2/20 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
SCHEMBL3114534 1.00 EP300 (0.40) EP300TBXAS1CD81MEN1KMT2A
SCHEMBL4434330 1.00 EP300 (0.40) EP300TBXAS1CD81MEN1KMT2A
SCHEMBL3109006 1.00 EP300 (0.40) EP300TBXAS1CD81MEN1KMT2A
SCHEMBL162503 0.98 EP300 (0.37) EP300TBXAS1CD81MEN1KMT2A
SCHEMBL1142168 0.92 MEN1 (0.35) EP300TBXAS1CD81MEN1KMT2A
SCHEMBL234427 0.84 MEN1 (0.38) CD81MEN1KMT2APPARG
SCHEMBL2049619 0.84 MEN1 (0.38) CD81MEN1KMT2APPARG
SCHEMBL1325679 0.84 EP300 (0.52) EP300TBXAS1CD81PPARG
SCHEMBL7857040 0.84 EP300 (0.52) EP300TBXAS1CD81PPARG
SCHEMBL4131095 0.84 EP300 (0.52) EP300TBXAS1CD81PPARG

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
US-20150352747-A1 BLADDER FOR TIRE VULCANIZATION DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2015-12-10 US disclosed
US-20130295209-A1 TIRE BLADDER DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2013-11-07 US disclosed
US-20130090424-A1 ACRYLIC RUBBER COMPOSITION, VULCANIZATE, HOSE PART, AND SEALING PART DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2013-04-11 US disclosed
US-20090155553-A1 Method of manufacturing surface metal film material, surface metal film material, method of manufacturing patterned metal material, patterned metal material, and polymer layer-forming composition FUJIFILM CORPORATION (JP) 2009-06-18 US disclosed