SCHEMBL7721146

SCHEMBL7721146

CCCCCCCCCCCCCCCCSc1ccccc1C=O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.52
EPHX2 P34913 1/20 0.47
CYSLTR2 Q9NS75 1/20 0.47
CYSLTR1 Q9Y271 1/20 0.47
SOAT1 P35610 9/20 0.43
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
THRB P10828 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GPR84 Q9NQS5 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
SCHEMBL11443812 1.00 PTGS2 (0.52) PTGS2EPHX2CYSLTR2CYSLTR1SOAT1
SCHEMBL9428564 1.00 PTGS2 (0.52) PTGS2EPHX2CYSLTR2CYSLTR1SOAT1
SCHEMBL9560125 1.00 PTGS2 (0.52) PTGS2EPHX2CYSLTR2CYSLTR1SOAT1
SCHEMBL11434977 1.00 PTGS2 (0.52) PTGS2EPHX2CYSLTR2CYSLTR1SOAT1
SCHEMBL9428037 1.00 PTGS2 (0.52) PTGS2EPHX2CYSLTR2CYSLTR1SOAT1
SCHEMBL6765848 0.98 PTGS2 (0.51) PTGS2EPHX2CYSLTR2CYSLTR1SOAT1
SCHEMBL8595709 0.93 PTGS2 (0.51) PTGS2EPHX2CYSLTR2CYSLTR1SOAT1
SCHEMBL7760109 0.86 PTGS2 (0.47) PTGS2EPHX2SOAT1MEN1LMNA
SCHEMBL19630504 0.85 PTGS2 (0.50) PTGS2EPHX2CYSLTR2CYSLTR1SOAT1
SCHEMBL9428247 0.83 HDAC1 (0.46) PTGS2MEN1LMNATHRBBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6381169-B1 FIXED ELECTRODES COUPLING TO STORAGE MEDIA THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-04-30 US disclosed