SCHEMBL3174388

SCHEMBL3174388

CCCCCCCCCCC1=C(CCCCCCCCCC)C(CCCCCCCCCC)(CCCCCCCCCC)C(=O)O1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 9/20 0.36
MMP2 P08253 4/20 0.35
MMP9 P14780 4/20 0.35
MMP8 P22894 4/20 0.35
MMP13 P45452 4/20 0.35
CDC25A P30304 6/20 0.34
CDC25B P30305 6/20 0.34
CDC25C P30307 5/20 0.34
SIRT2 Q8IXJ6 1/20 0.31

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
SCHEMBL1023716 0.72 MMP2 (0.38) MMP2MMP9MMP8MMP13SIRT2
SCHEMBL1023104 0.72 MMP2 (0.38) MMP2MMP9MMP8MMP13SIRT2
SCHEMBL1023054 0.72 MMP2 (0.38) MMP2MMP9MMP8MMP13SIRT2
SCHEMBL9721856 0.69 ELANE (0.39) MMP2MMP9MMP8MMP13
SCHEMBL21958419 0.69 MMP2 (0.41) MMP2MMP9MMP8MMP13CDC25B
SCHEMBL3679490 0.67 MMP2 (0.46) MMP2MMP9MMP8MMP13SIRT2
SCHEMBL3684753 0.67 MMP2 (0.46) MMP2MMP9MMP8MMP13SIRT2
SCHEMBL3679622 0.67 MMP2 (0.46) MMP2MMP9MMP8MMP13SIRT2
SCHEMBL25205553 0.66 SIRT2 (0.38) MMP2MMP9MMP8MMP13CDC25A
SCHEMBL8920856 0.66 SIRT2 (0.38) MMP2MMP9MMP8MMP13CDC25A

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
WO-2009143065-A2 RICE BRAN EXTRACTS AND METHODS OF USE THEREOF RICE SCIENCE, LLC (US) 2009-11-26 WO claimed
US-20100015258-A1 Rice Bran Extracts and Methods of Use Thereof HALPERN, BARUCH 2010-01-21 US disclosed