SCHEMBL2279338

SCHEMBL2279338

COc1c(C(=O)/C=C/c2cccc(OCC(=O)O)c2)c(=O)n(C)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PADI4 Q9UM07 4/20 0.53
ABCG2 Q9UNQ0 3/20 0.46
BCHE P06276 2/20 0.45
KCNA3 P22001 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PPARG P37231 2/20 0.43
LMNA P02545 1/20 0.42
CYSLTR2 Q9NS75 1/20 0.41
PPARA Q07869 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NQO1 P15559 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
FOS P01100 1/20 0.40
JUN P05412 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
SCHEMBL2279341 1.00 PADI4 (0.53) PADI4ABCG2BCHEKCNA3L3MBTL1
SCHEMBL2283091 0.92 PADI4 (0.50) PADI4ABCG2BCHEKCNA3L3MBTL1
SCHEMBL2283097 0.92 PADI4 (0.50) PADI4ABCG2BCHEKCNA3L3MBTL1
SCHEMBL2278731 0.89 PADI4 (0.50) PADI4ABCG2PPARGCYSLTR2KDM4E
SCHEMBL2278736 0.89 PADI4 (0.50) PADI4ABCG2PPARGCYSLTR2KDM4E
SCHEMBL2280088 0.81 PADI4 (0.48) PADI4ABCG2L3MBTL1LMNACYSLTR2
SCHEMBL2280086 0.81 PADI4 (0.48) PADI4ABCG2L3MBTL1LMNACYSLTR2
SCHEMBL2278507 0.80 ABCG2 (0.50) ABCG2BCHEKCNA3L3MBTL1PPARG
SCHEMBL2278509 0.80 ABCG2 (0.50) ABCG2BCHEKCNA3L3MBTL1PPARG
SCHEMBL2283908 0.78 ABCG2 (0.47) ABCG2BCHEL3MBTL1PPARGCYSLTR2

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-7989478-B2 decreases expression of a Type I collage gene in a tissue to induce a reduction in accumulation of collagen and thereby improves tissue fibrosis SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-02 US disclosed
EP-1671948-A1 CINNAMOYL COMPOUND AND USE OF THE SAME Sumitomo Chemical Company, Limited (JP) 2006-06-21 EP disclosed