SCHEMBL4391898

SCHEMBL4391898

Cc1ccc([C]=O)c(OS(C)(=O)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.49
CA2 P00918 3/20 0.49
CA9 Q16790 3/20 0.49
ACHE P22303 1/20 0.35
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
ALPL P05186 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.33
ELANE P08246 1/20 0.32
USP2 O75604 1/20 0.32
GAA P10253 1/20 0.32
PDE4B Q07343 1/20 0.31
SLC22A12 Q96S37 5/20 0.31
HPGD P15428 1/20 0.30
PPARA Q07869 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL6937345 0.77 CA1 (0.55) CA1CA2CA9ACHEKMT2A
SCHEMBL6210428 0.77 ACHE (0.56) CA1CA2CA9ACHEKMT2A
SCHEMBL9958393 0.76 ACHE (0.65) CA1CA2CA9ACHEKMT2A
SCHEMBL14872750 0.74 CA1 (0.52) CA1CA2CA9ACHEKMT2A
SCHEMBL17355701 0.74 CA1 (0.56) CA1CA2CA9ACHEKMT2A
SCHEMBL14872751 0.74 CA1 (0.56) CA1CA2CA9ACHEKMT2A
SCHEMBL9957651 0.74 ACHE (0.63) CA1CA2CA9ACHEKMT2A
SCHEMBL6937925 0.73 CA1 (0.55) CA1CA2CA9ACHEKMT2A
SCHEMBL4128378 0.73 CA1 (0.50) CA1CA2CA9ACHEKMT2A
SCHEMBL31364096 0.71 CA1 (0.49) CA1CA2CA9KDM4ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8211984-B2 Ring-opening metathesis polymer, hydrogenated product thereof, method for preparing the same, and use thereof MITSUI CHEMICALS, INC. (JP) 2012-07-03 US disclosed
US-20090215974-A1 RING-OPENING METATHESIS POLYMER, HYDROGENATED PRODUCT THEREOF, METHOD FOR PREPARING THE SAME, AND USE THEREOF MITSUI CHEMICALS INC (JP) 2009-08-27 US disclosed