SCHEMBL7090986

SCHEMBL7090986

CCCCC(CCCC)(Oc1ccccc1)C(C)S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
LTA4H P09960 1/20 0.35
KAT6A Q92794 1/20 0.34
MMP1 P03956 3/20 0.34
MMP7 P09237 3/20 0.34
MMP12 P39900 3/20 0.34
MMP13 P45452 3/20 0.34
ACE P12821 2/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
KIF11 P52732 1/20 0.34
FDPS P14324 1/20 0.34

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
SCHEMBL3849280 0.72 S1PR1 (0.38) ALDH1A1TSHRLTA4HMMP1MMP13
SCHEMBL2126729 0.72 S1PR1 (0.41) ALDH1A1TSHRLTA4HMMP1MMP13
SCHEMBL515722 0.70 LTA4H (0.44) TDP1LTA4HGAAZDHHC2FDPS
SCHEMBL292317 0.70 LTA4H (0.44) TDP1LTA4HGAAFDPS
Sulfuric Acid SCHEMBL9614195 0.70 PPARG (0.42) MMP1MMP13GAAZDHHC2
SCHEMBL9444975 0.69 PPARA (0.40) MMP1MMP13GAAZDHHC2
SCHEMBL5514895 0.69 PPARG (0.43) ALDH1A1TDP1LTA4H
SCHEMBL2126385 0.69 S1PR1 (0.43) ALDH1A1LTA4HMMP1MMP13GAA
SCHEMBL3849276 0.69 CA2 (0.40) ALDH1A1MMP1MMP7MMP12MMP13
SCHEMBL10481828 0.68 LTA4H (0.43) TDP1LTA4HGAAFDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030091933-A1 Photosensitive composition and negative working lithographic printing plate FUJIFILM CORPORATION (JP) 2003-05-15 US disclosed