SCHEMBL15865166

SCHEMBL15865166

CCCCCCCCOC(=O)N=NC(=O)OCc1ccccc1.CCCCCCCOC(=O)N=NC(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
TSHR P16473 4/20 0.57
CYP3A4 P08684 3/20 0.57
MAPK1 P28482 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
LMNA P02545 2/20 0.53
CETP P11597 3/20 0.51
TP53 P04637 1/20 0.50
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PPARG P37231 3/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NR1I2 O75469 1/20 0.44
CHRM2 P08172 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
SCHEMBL15843807 1.00 ALDH1A1 (0.57) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL15843520 1.00 ALDH1A1 (0.57) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL15843517 1.00 ALDH1A1 (0.57) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL15864795 1.00 ALDH1A1 (0.57) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL15843518 1.00 ALDH1A1 (0.57) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL15843519 1.00 ALDH1A1 (0.57) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL15843808 1.00 ALDH1A1 (0.57) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL15842994 0.98 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL15842993 0.98 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL15843752 0.94 ALDH1A1 (0.64) ALDH1A1TSHRCYP3A4MAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014107447-A1 FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2014-07-10 WO claimed