SCHEMBL15843751

SCHEMBL15843751

CCCCOC(=O)/N=N/C(=O)OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.64
TSHR P16473 5/20 0.64
L3MBTL1 Q9Y468 4/20 0.64
MAPK1 P28482 4/20 0.64
TDP1 Q9NUW8 3/20 0.64
CYP3A4 P08684 2/20 0.64
CETP P11597 3/20 0.47
LMNA P02545 3/20 0.45
TP53 P04637 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.44
ESR1 P03372 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
NR1H2 P55055 1/20 0.44
RNASEL Q05823 1/20 0.44
SMN1; SMN2 Q16637 1/20 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
SCHEMBL15843752 1.00 ALDH1A1 (0.64) ALDH1A1TSHRL3MBTL1MAPK1TDP1
SCHEMBL15842994 0.95 ALDH1A1 (0.58) ALDH1A1TSHRL3MBTL1MAPK1TDP1
SCHEMBL15842993 0.95 ALDH1A1 (0.58) ALDH1A1TSHRL3MBTL1MAPK1TDP1
SCHEMBL15843808 0.94 ALDH1A1 (0.57) ALDH1A1TSHRL3MBTL1MAPK1TDP1
SCHEMBL15865166 0.94 ALDH1A1 (0.57) ALDH1A1TSHRL3MBTL1MAPK1TDP1
SCHEMBL15843518 0.94 ALDH1A1 (0.57) ALDH1A1TSHRL3MBTL1MAPK1TDP1
SCHEMBL15843517 0.94 ALDH1A1 (0.57) ALDH1A1TSHRL3MBTL1MAPK1TDP1
SCHEMBL15864795 0.94 ALDH1A1 (0.57) ALDH1A1TSHRL3MBTL1MAPK1TDP1
SCHEMBL15843807 0.94 ALDH1A1 (0.57) ALDH1A1TSHRL3MBTL1MAPK1TDP1
SCHEMBL15843519 0.94 ALDH1A1 (0.57) ALDH1A1TSHRL3MBTL1MAPK1TDP1

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-9315599-B2 Functionalized polymers BRIDGESTONE CORPORATION (JP) 2016-04-19 US claimed
US-20140187712-A1 FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2014-07-03 US claimed
US-9315599-B2 Functionalized polymers BRIDGESTONE CORPORATION (JP) 2016-04-19 US disclosed
WO-2014107447-A1 FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2014-07-10 WO disclosed
US-20140187712-A1 FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2014-07-03 US disclosed