SCHEMBL4615424

SCHEMBL4615424

CCCCC(CC)COC(=O)C(CC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)O.[NaH]

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.66
CYP3A4 P08684 4/20 0.41
TSHR P16473 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
ATM Q13315 1/20 0.41
ALDH1A1 P00352 5/20 0.35
CA2 P00918 1/20 0.35
LMNA P02545 3/20 0.33
MAPK1 P28482 3/20 0.32
HSD17B10 Q99714 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP14 P50281 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7104867 0.99 RECQL (0.67) RECQLCYP3A4TSHRTDP1ATM
SCHEMBL4615430 0.96 RECQL (0.66) RECQLCYP3A4TSHRTDP1ATM
SCHEMBL7104872 0.95 RECQL (0.67) RECQLCYP3A4TSHRTDP1ATM
SCHEMBL4614916 0.86 RECQL (0.70) RECQLCYP3A4TSHRTDP1ATM
SCHEMBL7101808 0.85 RECQL (0.72) RECQLCYP3A4TSHRTDP1ATM
SCHEMBL4614919 0.84 RECQL (0.70) RECQLCYP3A4TSHRTDP1ATM
SCHEMBL5667213 0.84 RECQL (0.42) RECQLTSHRCA2MAPK1PRSS1
SCHEMBL4612751 0.84 RECQL (0.42) RECQLTSHRCA2MAPK1PRSS1
SCHEMBL7101815 0.83 RECQL (0.72) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL1996246 0.82 RECQL (0.97) RECQLCYP3A4TSHRTDP1ATM

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
EP-1345074-B1 Silver halide photographic light-sensitive material comprising a hydrocarbon and a fluorinated surfactant FUJIFILM CORP (JP) 2008-02-20 EP disclosed
US-7005250-B2 Silver halide color photographic lightsensitive material FUJI PHOTO FILM CO., LTD. (JP) 2006-02-28 US disclosed