SCHEMBL9109323

SCHEMBL9109323

CCCCCCCCSC(CC(=O)O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 14/20 0.47
CYSLTR1 Q9Y271 14/20 0.47
SOAT2 O75908 1/20 0.46
ACAT1 P24752 1/20 0.46
SOAT1 P35610 1/20 0.46
NAAA Q02083 2/20 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
SCHEMBL9109873 1.00 CYSLTR2 (0.47) CYSLTR2CYSLTR1SOAT2ACAT1SOAT1
SCHEMBL7754848 0.88 ALDH1A1 (0.43) CYSLTR2CYSLTR1SOAT2ACAT1SOAT1
SCHEMBL14602856 0.87 PDPK1 (0.51) CYSLTR2CYSLTR1SOAT2ACAT1SOAT1
SCHEMBL14602841 0.87 PDPK1 (0.51) CYSLTR2CYSLTR1SOAT2ACAT1SOAT1
SCHEMBL8757678 0.87 PDPK1 (0.42) CYSLTR2CYSLTR1
SCHEMBL28937529 0.87 PDPK1 (0.51) CYSLTR2CYSLTR1SOAT2ACAT1SOAT1
SCHEMBL8757566 0.86 PDPK1 (0.40) CYSLTR2CYSLTR1SOAT2ACAT1SOAT1
SCHEMBL8757717 0.85 PDPK1 (0.40) CYSLTR2CYSLTR1
SCHEMBL8757719 0.83 MMP2 (0.43) CYSLTR2CYSLTR1NAAA
SCHEMBL28041002 0.83 PDPK1 (0.50) SOAT2ACAT1SOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501312-B2 Charging member CANON KABUSHIKI KAISHA (JP) 2013-08-06 US disclosed
US-20120141161-A1 CHARGING MEMBER CANON KABUSHIKI KAISHA (JP) 2012-06-07 US disclosed