SCHEMBL5400571

SCHEMBL5400571

CCCCCCCCC(CCCS(=O)(=O)O)c1ccccc1.[NaH]

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.47
S1PR2 O95136 1/20 0.44
S1PR1 P21453 1/20 0.44
S1PR3 Q99500 1/20 0.44
NAAA Q02083 3/20 0.43
ASAH1 Q13510 2/20 0.42
CYSLTR2 Q9NS75 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.40
CSNK1E P49674 1/20 0.38
ALDH1A1 P00352 2/20 0.38
ACER2 Q5QJU3 1/20 0.38
CERT1 Q9Y5P4 2/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38

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
SCHEMBL9641527 0.93 S1PR2 (0.48) NR1I2S1PR2S1PR1S1PR3NAAA
SCHEMBL9641509 0.85 NR1I2 (0.49) NR1I2S1PR2S1PR1S1PR3NAAA
SCHEMBL5678177 0.85 NR1I2 (0.49) NR1I2S1PR2S1PR1S1PR3NAAA
SCHEMBL9641227 0.85 NR1I2 (0.49) NR1I2S1PR2S1PR1S1PR3NAAA
SCHEMBL10615879 0.84 NR1I2 (0.47) NR1I2NAAAASAH1CYSLTR2CYSLTR1
SCHEMBL5400565 0.82 NR1I2 (0.57) NR1I2NAAAASAH1CYSLTR2CYSLTR1
SCHEMBL23849703 0.82 NR1I2 (0.49) NR1I2NAAAASAH1CYSLTR2CYSLTR1
SCHEMBL21633686 0.82 NR1I2 (0.49) NR1I2NAAAASAH1CYSLTR2CYSLTR1
SCHEMBL20291563 0.82 NR1I2 (0.49) NR1I2NAAAASAH1CYSLTR2CYSLTR1
SCHEMBL21633712 0.82 NR1I2 (0.49) NR1I2NAAAASAH1CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7261159-B2 Perforating method SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2007-08-28 US claimed
US-20060278392-A1 Perforating Method SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2006-12-14 US claimed
US-7261159-B2 Perforating method SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2007-08-28 US disclosed
US-20060278392-A1 Perforating Method SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2006-12-14 US disclosed