SCHEMBL7385202

SCHEMBL7385202

O=CCCCCCCS(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.44
TSHR P16473 2/20 0.44
APP P05067 1/20 0.44
HIF1A Q16665 1/20 0.43
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 2/20 0.39
PTGS1 P23219 1/20 0.36
PDE4A P27815 1/20 0.36
LMNA P02545 1/20 0.36
SLC6A6 P31641 1/20 0.36
CYP2C19 P33261 1/20 0.36
BLM P54132 1/20 0.36
PPARA Q07869 1/20 0.31

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
SCHEMBL27790845 1.00 EPHX2 (0.44) EPHX2TSHRAPPHIF1AFAAH
SCHEMBL7283408 1.00 EPHX2 (0.44) EPHX2TSHRAPPHIF1AFAAH
SCHEMBL6013596 1.00 EPHX2 (0.44) EPHX2TSHRAPPHIF1AFAAH
SCHEMBL7377028 1.00 EPHX2 (0.44) EPHX2TSHRAPPHIF1AFAAH
SCHEMBL19152994 1.00 EPHX2 (0.44) EPHX2TSHRAPPHIF1AFAAH
SCHEMBL3044857 1.00 EPHX2 (0.44) EPHX2TSHRAPPHIF1AFAAH
SCHEMBL6013591 0.97 APP (0.46) EPHX2TSHRAPPHIF1AFAAH
SCHEMBL3038000 0.90
SCHEMBL8736287 0.87 APP (0.46) EPHX2TSHRAPPHIF1AFAAH
SCHEMBL1270542 0.81 APP (0.61) EPHX2TSHRAPPFAAHPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2883867-A2 Non-aqueous electrolytic solution, electrochemical element using the same and alkynyl compound used therefor Ube Industries, Ltd. (JP) 2015-06-17 EP disclosed
EP-2533344-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, ELECTROCHEMICAL ELEMENT USING SAME, AND ALKYNYL COMPOUND USED THEREFOR Ube Industries, Ltd. (JP) 2012-12-12 EP disclosed
US-5401722-A Peptide analogues MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-03-28 US disclosed
US-5378691-A Amino acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-01-03 US disclosed
US-5328916-A Renin inhibitors, hypotensive agents MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1994-07-12 US disclosed
US-5147857-A Enzyme inhibitors MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1992-09-15 US disclosed
EP-0501280-A2 Renin-inhibiting peptide analogues MERCK PATENT GmbH (DE) 1992-09-02 EP disclosed
EP-0499080-A2 Aminoacid derivatibes MERCK PATENT GmbH (DE) 1992-08-19 EP disclosed
EP-0481311-A2 Aminoacid derivatives MERCK PATENT GmbH (DE) 1992-04-22 EP disclosed
EP-0474008-A1 Amino acid derivatives MERCK PATENT GmbH (DE) 1992-03-11 EP disclosed
EP-0464517-A2 Amino acid derivatives with renin inhibiting activity MERCK PATENT GmbH (DE) 1992-01-08 EP disclosed
EP-0456039-A2 Renin inhibiting amino acid derivatives MERCK PATENT GmbH (DE) 1991-11-13 EP disclosed
EP-0446485-A2 Peptide analogues with renininhibiting activity MERCK PATENT GmbH (DE) 1991-09-18 EP disclosed
EP-0446751-A1 Glycolic acid derivatives MERCK PATENT GmbH (DE) 1991-09-18 EP disclosed
CN-1037155-A Amino acid derivative MERCK PATENT GMBH (DE) 1989-11-15 CN disclosed