SCHEMBL3278439

SCHEMBL3278439

CCCCN(C=C(C)C(=O)O)CCCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA9 Q16790 2/20 0.38
EP300 Q09472 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP8 P22894 1/20 0.35
FNTA P49354 2/20 0.34
FNTB P49356 2/20 0.34
THRB P10828 1/20 0.34
PGGT1B P53609 1/20 0.34
ALOX15 P16050 2/20 0.33
AKR1B1 P15121 1/20 0.33
EPHX2 P34913 1/20 0.33
KDM5A P29375 2/20 0.33
KDM4C Q9H3R0 1/20 0.33
PPARG P37231 4/20 0.32
PPARD Q03181 4/20 0.32
PPARA Q07869 4/20 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
SCHEMBL3278436 1.00 CA12 (0.38) CA12CA1CA9EP300MMP1
SCHEMBL3282913 0.92 EP300 (0.41) EP300FNTAFNTBTHRBPGGT1B
SCHEMBL3285689 0.92 EP300 (0.41) EP300FNTAFNTBTHRBPGGT1B
SCHEMBL3285692 0.92 EP300 (0.41) EP300FNTAFNTBTHRBPGGT1B
SCHEMBL3282909 0.92 EP300 (0.41) EP300FNTAFNTBTHRBPGGT1B
SCHEMBL3278721 0.92 EP300 (0.41) EP300FNTAFNTBTHRBPGGT1B
SCHEMBL3278720 0.92 EP300 (0.41) EP300FNTAFNTBTHRBPGGT1B
Bromide SCHEMBL28566612 0.89 DNM1 (0.35) CA12CA1CA9EP300MMP1
Hydrochloric Acid SCHEMBL28732737 0.89 DNM1 (0.35) CA12CA1CA9EP300MMP1
SCHEMBL3285600 0.87 CA12 (0.33) CA12CA9TSHR

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
US-20070113353-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY 2007-05-24 US claimed
US-20100160487-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY (US) 2010-06-24 US disclosed
US-7699941-B2 Polymeric surface treatment compositions THE CLOROX COMPANY (US) 2010-04-20 US disclosed
US-20070113353-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY 2007-05-24 US disclosed