SCHEMBL4577815

SCHEMBL4577815

C=CC(=O)OC(C)NS(=O)(=O)C(F)(CCCC)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
MMP1 P03956 3/20 0.32
MMP2 P08253 3/20 0.32
MMP9 P14780 3/20 0.32
MMP8 P22894 3/20 0.32
MMP13 P45452 3/20 0.32
TSHR P16473 2/20 0.32
HPGD P15428 1/20 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
SCHEMBL28902869 0.93 CA1 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL8214170 0.88 CA1 (0.35) CA1CA2MMP1MMP2MMP9
SCHEMBL28384329 0.80 CA2 (0.50) CA1CA2MMP1MMP2MMP9
SCHEMBL5399537 0.80 CA2 (0.50) CA1CA2MMP1MMP2MMP9
SCHEMBL4650786 0.79 CA1 (0.37) CA1CA2MMP1MMP2MMP9
SCHEMBL325042 0.79 CA1 (0.51) CA1CA2MMP1MMP2MMP9
SCHEMBL3458873 0.78 CA1 (0.38) CA1CA2MMP1MMP2MMP9
SCHEMBL4013920 0.77 TSHR (0.43) TSHRHPGD
SCHEMBL10062664 0.74 TSHR (0.34) CA1CA2MMP1MMP2MMP9
SCHEMBL7913883 0.73 CA1 (0.40) CA1CA2MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6451747-B1 NOVEL DETERGENT AND CONDITIONING HAIR CARE COMPOSITIONS COMPRISING, IN A COSMETICALLY ACCEPTABLE MEDIUM, (A) A WASHING BASE AND (B) A CONDITIONING SYSTEM COMPRISING AT LEAST ONE CATIONIC POLYMER AND A MIXTURE OF AT LEAST ONE AMINE L'OREAL S.A. (FR) 2002-09-17 US claimed
US-7449282-B2 Lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2008-11-11 US disclosed
US-7374863-B2 Polyurethane binder, photoinitiator, and acrylic acid; for use as image recording layer of negative lithographic printing plate precursor; drawing with laser light FUJIFILM CORPORATION (JP) 2008-05-20 US disclosed
US-20050255404-A1 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. 2005-11-17 US disclosed
US-20050170285-A1 Polyurethane binder, photoinitiator, and acrylic acid; for use as image recording layer of negative lithographic printing plate precursor; drawing with laser light FUJI PHOTO FILM CO., LTD. 2005-08-04 US disclosed