SCHEMBL6155810

SCHEMBL6155810

CC(=O)OC[C@@H](COS(=O)(=O)c1ccc(C)cc1)Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
CTSL P07711 1/20 0.43
LMNA P02545 2/20 0.43
CA2 P00918 3/20 0.41
CA1 P00915 2/20 0.41
MAPT P10636 1/20 0.40
ALDH1A1 P00352 3/20 0.40
CA7 P43166 1/20 0.40
P2RX7 Q99572 2/20 0.40
DHODH Q02127 1/20 0.40
GLA P06280 1/20 0.39
THRB P10828 1/20 0.39
STAT3 P40763 1/20 0.39
POLB P06746 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL17460433 0.90 CA2 (0.47) GAACTSLLMNACA2ALDH1A1
SCHEMBL6153740 0.85 GAA (0.44) GAACTSLLMNACA2ALDH1A1
SCHEMBL18857832 0.83 CA2 (0.44) GAACTSLLMNACA2ALDH1A1
SCHEMBL6153593 0.82 ALDH1A1 (0.46) CA2ALDH1A1CA7POLBKMT2A
SCHEMBL6154154 0.82 ALDH1A1 (0.46) CA2ALDH1A1CA7POLBKMT2A
SCHEMBL6154318 0.82 ALDH1A1 (0.46) CA2ALDH1A1CA7POLBKMT2A
SCHEMBL6154419 0.81 ALDH1A1 (0.58) LMNAALDH1A1POLBPPARGPPARA
SCHEMBL6155171 0.80 CYP1A2 (0.50) GAACTSLLMNACA2ALDH1A1
SCHEMBL7925816 0.79 GAA (0.49) GAACTSLLMNACA2ALDH1A1
SCHEMBL21378598 0.79 GAA (0.49) GAACTSLLMNACA2ALDH1A1

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 3 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