SCHEMBL7086706

SCHEMBL7086706

CCCCC(CCCC)c1ccccc1C=NO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.40
USP2 O75604 1/20 0.38
FGF23 Q9GZV9 1/20 0.37
HPGD P15428 7/20 0.36
TSHR P16473 4/20 0.36
MAPK1 P28482 2/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 3/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
APAF1 O14727 1/20 0.36
HSP90AA1 P07900 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALOX12 P18054 1/20 0.35

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
SCHEMBL8575511 0.94 CYSLTR2 (0.36) CYSLTR2CYSLTR1USP2FGF23HPGD
SCHEMBL7984330 0.92 CYSLTR2 (0.38) CYSLTR2CYSLTR1USP2FGF23HPGD
SCHEMBL5360505 0.92 CYSLTR2 (0.35) CYSLTR2CYSLTR1USP2FGF23HPGD
SCHEMBL10781131 0.87 USP2 (0.36) CYSLTR2CYSLTR1USP2FGF23HPGD
SCHEMBL2284723 0.86 CYSLTR2 (0.39) CYSLTR2CYSLTR1USP2MAPK1ALDH1A1
SCHEMBL9761889 0.86 ALOX12 (0.45) CYSLTR2CYSLTR1USP2HPGDTSHR
SCHEMBL9761348 0.83 ALOX12 (0.42) CYSLTR2CYSLTR1MAPK1HTTMAPT
SCHEMBL5897174 0.82 USP2 (0.35) USP2FGF23HPGDTSHRMAPK1
SCHEMBL5897743 0.77 USP2 (0.35) USP2FGF23HPGDTSHRMAPK1
SCHEMBL1880780 0.75 CYSLTR2 (0.40) CYSLTR2CYSLTR1HPGDTSHRALDH1A1

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-2003070993-A1 DEVICE AND PROCESS FOR SOLVENT EXTRACTION UMATILLA RESOURCES PTY LTD (AU) 2003-08-28 WO disclosed