SCHEMBL5085937

SCHEMBL5085937

CC(C)c1ccc2sc(S(N)(=O)=O)nc2c1C(C)C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 20/20 0.43
CA1 P00915 7/20 0.43
CA4 P22748 4/20 0.43
CA12 O43570 3/20 0.43
CA14 Q9ULX7 3/20 0.43
CA7 P43166 2/20 0.43
CA5A P35218 3/20 0.40
CA6 P23280 2/20 0.40
CA9 Q16790 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
CA3 P07451 1/20 0.40
PKM P14618 1/20 0.40
KMT2A Q03164 1/20 0.40
HIF1A Q16665 1/20 0.40
CA13 Q8N1Q1 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL31250073 1.00 CA2 (0.43) CA2CA1CA4CA12CA14
SCHEMBL20275971 0.74 NPC1 (0.42) KDM4ELMNAPKMKMT2A
SCHEMBL30933285 0.73
SCHEMBL29157734 0.71
SCHEMBL6094079 0.69 CA2 (0.56) CA2CA1CA4CA12CA14
SCHEMBL14299650 0.69 CA2 (0.61) CA2CA1CA4CA12CA14
SCHEMBL9811144 0.69
SCHEMBL9811142 0.68 ACACB (0.32)
SCHEMBL10347946 0.68 CA2 (0.43) CA2CA1CA4CA12CA14
SCHEMBL10347933 0.67 CA2 (0.57) CA2CA1CA4CA12CA14

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
CN-101193970-B Plasticized polyolefin compositions EXXON MOBIL CHEM PATENTS INC 2012-06-20 CN disclosed
CN-101193970-A Plasticized polyolefin compositions EXXONMOBIL CHEM PATENTS INC (US) 2008-06-04 CN disclosed
EP-1893686-A1 PLASTICIZED POLYOLEFIN COMPOSITIONS ExxonMobil Chemical Patents, Inc., A Corporation of the State of Delaware (US) 2008-03-05 EP disclosed
WO-2006118674-A1 PLASTICIZED POLYOLEFIN COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-11-09 WO disclosed