SCHEMBL13678665

SCHEMBL13678665

O=C(CSCCC(=O)ON1C(=O)CCC1=O)NCc1ccc(CNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.52
▸ SLC5A2 P31639 3/20 0.51
▸ ALB P02768 2/20 0.48
▸ CA9 Q16790 5/20 0.47
▸ CA1 P00915 3/20 0.47
▸ CA2 P00918 3/20 0.47
▸ CA12 O43570 2/20 0.47
▸ CA14 Q9ULX7 2/20 0.47
▸ FOLH1 Q04609 3/20 0.46
▸ USP2 O75604 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ HAVCR2 Q8TDQ0 1/20 0.44
▸ CA7 P43166 1/20 0.42

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
SCHEMBL1688099 0.93 FOLH1 (0.51) ESR1SLC5A2ALBCA9CA1
SCHEMBL10145843 0.92 ESR1 (0.43) ESR1SLC5A2ALBCA9CA1
SCHEMBL9906325 0.92 FOLH1 (0.54) ESR1SLC5A2ALBCA9CA1
SCHEMBL9906321 0.91 FOLH1 (0.55) ESR1SLC5A2ALBCA9CA1
SCHEMBL9906227 0.91 SLC5A2 (0.49) ESR1SLC5A2ALBCA9CA1
SCHEMBL9906326 0.90 FOLH1 (0.56) ESR1SLC5A2ALBCA9CA1
SCHEMBL9906327 0.89 FOLH1 (0.52) ESR1SLC5A2ALBCA9CA1
SCHEMBL9906226 0.88 ALB (0.49) ESR1ALBCA9FOLH1USP2
SCHEMBL14619724 0.87 USP2 (0.45) ESR1SLC5A2ALBCA9CA1
SCHEMBL9906261 0.87 ALB (0.52) SLC5A2ALBFOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1673399-B1 DETECTING AND PROFILING MOLECULAR COMPLEXES MONOGRAM BIOSCIENCES INC (US) 2017-04-05 — — EP disclosed
EP-1540347-B1 DETECTING RECEPTOR OLIGOMERIZATION ACLARA BIOSCIENCES INC (US) 2009-09-09 — — EP disclosed
US-20090173631-A1 Single Cell Analysis of Membrane Molecules ACLARA BIOSCIENCES, INC. 2009-07-09 — — US disclosed
US-20090011432-A1 Detecting and Profiling Molecular Complexes MONOGRAM BIOSCIENCES, INC. (US) 2009-01-08 — — US disclosed
US-7402397-B2 Detecting and profiling molecular complexes MONOGRAM BIOSCIENCES, INC. (US) 2008-07-22 — — US disclosed
US-7255999-B2 Detection of preferential polypetide in sample; otain sample containing preferential polyeptide, electrophorese, incubate with probe, detect signal from probe and recover polypeptide MONOGRAM BIOSCIENCES, INC. (US) 2007-08-14 — — US disclosed
US-7217531-B2 Multiplex analysis using membrane-bound sensitizers MONOGRAM BIOSCIENCES (US) 2007-05-15 — — US disclosed
US-7160735-B2 Tagged microparticle compositions and methods MONOGRAM BIOSCIENCES, INC. (US) 2007-01-09 — — US disclosed
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