SCHEMBL6154367

SCHEMBL6154367

CS(=O)(=O)OC[C@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
CPA1 P15085 7/20 0.53
CPA3 P15088 3/20 0.53
FOLH1 Q04609 3/20 0.53
CPB1 P15086 1/20 0.53
CPB2 Q96IY4 1/20 0.53
SLC1A3 P43003 1/20 0.49
SLC1A2 P43004 1/20 0.49
SLC1A1 P43005 1/20 0.49
MME P08473 1/20 0.46
NAALAD2 Q9Y3Q0 1/20 0.45
ANPEP P15144 1/20 0.44
RNPEP Q9H4A4 1/20 0.44
DNPEP Q9ULA0 1/20 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
SCHEMBL6427020 1.00 CYP1A2 (0.59) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL6154118 1.00 CYP1A2 (0.59) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL6155501 0.86 KMT2A (0.47) CYP1A2MME
SCHEMBL8446169 0.86 KMT2A (0.47) CYP1A2MME
SCHEMBL29096794 0.83 SLC1A1 (0.57) CYP1A2FOLH1SLC1A1MME
SCHEMBL19281761 0.82 MME (0.60) CYP1A2MME
SCHEMBL19358304 0.81 MME (0.53) MME
SCHEMBL6155171 0.80 CYP1A2 (0.50) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL4756135 0.80 CA1 (0.40) CYP1A2
SCHEMBL4756128 0.80 CA1 (0.40) CYP1A2

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
EP-0916654-B1 SULFONIC ESTER DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND USE THEREOF KANEKA CORP (JP) 2005-02-23 EP disclosed
US-6410773-B1 OPTICAL ACTIVE MATERIAL; ENKEPHALINASE INHIBITORS; HYPOTENSIVE AGENTS KANEKA CORPORATION (JP) 2002-06-25 US disclosed
US-6121477-A Sulfonic ester derivatives, process for preparing the same, and use thereof KANEKA CORPORATION (JP) 2000-09-19 US disclosed
EP-0916654-A1 SULFONIC ESTER DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND USE THEREOF KANEKA CORPORATION (JP) 1999-05-19 EP disclosed