SCHEMBL10145843

SCHEMBL10145843

O=Nc1ccc2c(-c3ccc(C(=O)NCc4ccc(CNC(=O)CSCCC(=O)ON5C(=O)CCC5=O)cc4)cc3C(=O)O)c3ccc(=O)cc-3oc2c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.43
▸ SLC5A2 P31639 3/20 0.43
▸ ALB P02768 2/20 0.40
▸ FOLH1 Q04609 2/20 0.39
▸ CA9 Q16790 3/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA14 Q9ULX7 1/20 0.39
▸ HAVCR2 Q8TDQ0 1/20 0.38
▸ PPIA P62937 1/20 0.36
▸ PPID Q08752 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ AVPR2 P30518 1/20 0.35
▸ OXTR P30559 1/20 0.35
▸ AVPR1A P37288 1/20 0.35

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
SCHEMBL13678665 0.92 ESR1 (0.52) ESR1SLC5A2ALBFOLH1CA9
SCHEMBL1688099 0.85 FOLH1 (0.51) ESR1SLC5A2ALBFOLH1CA9
SCHEMBL9906325 0.84 FOLH1 (0.54) ESR1SLC5A2ALBFOLH1CA9
SCHEMBL9906227 0.83 SLC5A2 (0.49) ESR1SLC5A2ALBFOLH1CA9
SCHEMBL9906321 0.83 FOLH1 (0.55) ESR1SLC5A2ALBFOLH1CA9
SCHEMBL9906326 0.82 FOLH1 (0.56) ESR1SLC5A2ALBFOLH1CA9
SCHEMBL9906327 0.81 FOLH1 (0.52) ESR1SLC5A2ALBFOLH1CA9
SCHEMBL9906226 0.80 ALB (0.49) ESR1ALBFOLH1CA9USP2
SCHEMBL14619724 0.79 USP2 (0.45) ESR1SLC5A2ALBFOLH1CA9
SCHEMBL9906261 0.79 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9110075-B2 Compositions for analyzing proteins MONOGRAM BIOSCIENCES, INC. (US) 2015-08-18 — — US disclosed
US-20120088307-A1 Methods and Compositions for Analyzing Proteins MONOGRAM BIOSCIENCES, INC. (US) 2012-04-12 — — US disclosed
US-20080311674-A1 METHODS AND COMPOSITIONS FOR ANALYZING PROTEINS MONOGRAM BIOSCIENCES, INC. (US) 2008-12-18 — — US disclosed
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