SCHEMBL4978414

SCHEMBL4978414

CCCC/C=C(\C(N)=O)N(CCC)CCC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.37
CA12 O43570 3/20 0.36
CA9 Q16790 3/20 0.36
CA2 P00918 1/20 0.36
EP300 Q09472 1/20 0.36
FAAH O00519 3/20 0.36
SOAT1 P35610 2/20 0.35
TP53 P04637 2/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
CA1 P00915 2/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 1/20 0.34
CNR1 P21554 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL4977299 0.93 CA12 (0.42) GRIK1CA12CA9CA2EP300
SCHEMBL4978049 0.89 CA12 (0.39) GRIK1CA12CA9CA2FAAH
SCHEMBL2505681 0.87 GRIK1 (0.38) GRIK1CA12CA9CA2EP300
SCHEMBL6447594 0.85 CA12 (0.42) GRIK1CA12CA9CA2EP300
SCHEMBL8604922 0.83 EP300 (0.46) GRIK1CA12CA9CA2EP300
SCHEMBL4975708 0.82 CA12 (0.40) CA12CA9CA2FAAHTP53
SCHEMBL6449552 0.82 FAAH (0.41) CA12CA9CA2EP300FAAH
SCHEMBL6446461 0.82 FAAH (0.41) CA12CA9CA2EP300FAAH
SCHEMBL2500222 0.81 ALDH1A1 (0.39) GRIK1CA2EP300FAAHSOAT1
SCHEMBL28735647 0.81 ALDH1A1 (0.39) GRIK1CA2EP300FAAHSOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2818505-B1 TIRE RUBBER COMPOSITION AND PNEUMATIC TIRE SUMITOMO RUBBER IND (JP) 2017-02-01 EP disclosed
EP-2787033-B1 RUBBER COMPOSITION FOR TYRE, AND PNEUMATIC TYRE SUMITOMO RUBBER IND (JP) 2016-09-14 EP disclosed
US-9340663-B2 Rubber composition for tire, and pneumatic tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2016-05-17 US disclosed
EP-2818505-A1 TIRE RUBBER COMPOSITION AND PNEUMATIC TIRE Sumitomo Rubber Industries, Ltd. (JP) 2014-12-31 EP disclosed
US-20140371372-A1 TIRE RUBBER COMPOSITION AND PNEUMATIC TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2014-12-18 US disclosed
US-20140323660-A1 RUBBER COMPOSITION FOR TIRE, AND PNEUMATIC TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2014-10-30 US disclosed
US-8865836-B2 Tire rubber composition and pneumatic tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2014-10-21 US disclosed
EP-2787033-A1 RUBBER COMPOSITION FOR TYRE, AND PNEUMATIC TYRE Sumitomo Rubber Industries, Ltd. (JP) 2014-10-08 EP disclosed
EP-2543702-B1 Tire rubber composition and pneumatic tire SUMITOMO RUBBER IND (JP) 2013-09-11 EP disclosed
US-20130012660-A1 TIRE RUBBER COMPOSITION AND PNEUMATIC TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2013-01-10 US disclosed
EP-2543702-A1 Tire rubber composition and pneumatic tire SUMITOMO RUBBER INDUSTRIES LIMITED (JP) 2013-01-09 EP disclosed
US-7339005-B2 Process for producing modified diene polymer rubber SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-03-04 US disclosed
US-20040152845-A1 Process for producing modified diene polymer rubber SUMITOMO CHEMICAL COMPANY, LIMITED 2004-08-05 US disclosed
US-4954343-A DRUG DELIVERY, (METH)ACRYLAMIDE WITH AMINO GROUP AS COPOLYMER NITTO ELECTRIC INDUSTRIAL CO., LTD. (JP) 1990-09-04 US disclosed