SCHEMBL7521234

SCHEMBL7521234

O=S(=O)(O)CC[CH]CCCCS(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.44
EPHX2 P34913 1/20 0.41
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

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
SCHEMBL10596261 0.87 APP (0.50) APPEPHX2PTGS1PDE4ALMNA
SCHEMBL3795027 0.87 PTGS1 (0.45) APPEPHX2PTGS1PDE4ALMNA
SCHEMBL4267538 0.84 EPHX2 (0.49) EPHX2
SCHEMBL16445681 0.84 EPHX2 (0.49) APPEPHX2PTGS1PDE4ALMNA
SCHEMBL8755997 0.83 APP (0.37) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL28065626 0.83 APP (0.42) APPEPHX2PTGS1PDE4ALMNA
SCHEMBL4273656 0.82 EPHX2 (0.51) EPHX2
SCHEMBL9390890 0.82 EPHX2 (0.51) EPHX2
SCHEMBL10695345 0.82 EPHX2 (0.60) EPHX2
SCHEMBL14243982 0.82 EPHX2 (0.51) EPHX2

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-1176987-A2 SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) 2002-02-06 EP disclosed
WO-2000061194-A2 SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) 2000-10-19 WO disclosed
US-5082759-A Liquid developer for electrostatic photography FUJI PHOTO FILM CO., LTD. (JP) 1992-01-21 US disclosed
EP-0465939-A1 Double reactive dyestuffs with four halogenetriazinyl anchors BASF Aktiengesellschaft (DE) 1992-01-15 EP disclosed