SCHEMBL8519669

SCHEMBL8519669

NC(=O)NOC(=O)C=CC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 11/20 0.52
TSHR P16473 3/20 0.43
TP53 P04637 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
EGLN3 Q9H6Z9 1/20 0.43
ALDH1A1 P00352 4/20 0.37
MAPT P10636 3/20 0.37
TDP1 Q9NUW8 3/20 0.37
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
ALOX15 P16050 1/20 0.34
RECQL P46063 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34

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
SCHEMBL8519666 1.00 HCAR2 (0.52) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL8519665 0.90 HCAR2 (0.43) HCAR2TSHRMAPTCYP1A2KEAP1
SCHEMBL365676 0.90 HCAR2 (0.43) HCAR2TSHRMAPTCYP1A2KEAP1
SCHEMBL8948049 0.80 HCAR2 (0.46) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL27601174 0.78 HCAR2 (0.54) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL28308759 0.77 KEAP1 (0.33) HCAR2TSHRMAPTKEAP1NFE2L2
SCHEMBL25177775 0.73 HCAR2 (0.48) HCAR2TSHRTP53EGLN1EGLN3
Monomethyl Fumarate SCHEMBL1907622 0.72 HCAR2 (0.94) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL28767804 0.72 HCAR2 (0.41) HCAR2ALDH1A1MAPTTDP1HSD17B10
Monomethyl Fumarate SCHEMBL1907625 0.72 HCAR2 (0.94) HCAR2TSHRTP53EGLN1EGLN3

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
EP-0928820-A2 Wet adhesion promoter CYTEC TECHNOLOGY CORP. (US) 1999-07-14 EP disclosed