SCHEMBL3407783

SCHEMBL3407783

CCCCCCCCOc1ccc([S+](c2ccc(C)cc2)c2ccc(C)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.56
LTA4H P09960 4/20 0.50
TP53 P04637 2/20 0.50
TSHR P16473 1/20 0.50
PLA2G4B P0C869 1/20 0.49
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
RARB P10826 3/20 0.46
NPC1 O15118 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
RAB9A P51151 1/20 0.46
HSD17B10 Q99714 1/20 0.46
THRA P10827 2/20 0.46
THRB P10828 2/20 0.46

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
Hydrochloric Acid SCHEMBL8969020 0.91 NR5A1 (0.61) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL13991627 0.89 NR5A1 (0.68) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL14583368 0.89 NR5A1 (0.68) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL7761726 0.89 NR5A1 (0.68) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL12122194 0.89 NR5A1 (0.68) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL22207170 0.89 NR5A1 (0.68) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL22207285 0.89 NR5A1 (0.68) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL21167283 0.89 NR5A1 (0.68) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL22207172 0.89 NR5A1 (0.68) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL22207529 0.89 NR5A1 (0.68) NR5A1LTA4HTP53TSHRPLA2G4B

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
US-7704668-B1 Photoresist compositions and methods and articles of manufacture comprising same ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2010-04-27 US disclosed