SCHEMBL9302672

SCHEMBL9302672

CCCCCS(=O)(=O)NCCCl

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RELA Q04206 4/20 0.53
CA2 P00918 5/20 0.41
CA1 P00915 4/20 0.41
CA12 O43570 1/20 0.41
CA7 P43166 1/20 0.41
CA14 Q9ULX7 1/20 0.41
PPARA Q07869 2/20 0.41
FAAH O00519 3/20 0.40
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
EPHX1 P07099 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL31299681 0.86 RELA (0.61) RELACA2CA1CA12CA7
SCHEMBL7100793 0.86 RELA (0.61) RELACA2CA1CA12CA7
SCHEMBL7103762 0.86 RELA (0.61) RELACA2CA1CA12CA7
SCHEMBL4998398 0.85 RELA (0.58) RELACA2CA1CA12CA7
SCHEMBL4556568 0.85 RELA (0.68) RELACA2CA1CA12CA7
SCHEMBL7101496 0.84 RELA (0.54) RELACA2CA1CA12CA7
SCHEMBL3816066 0.83 CA1 (0.52) RELACA2CA1CA12CA7
SCHEMBL1148893 0.83 RELA (0.45) RELACA2CA1CA12CA7
SCHEMBL9609767 0.83 RELA (0.71) RELACA2CA1CA12CA7
SCHEMBL7694320 0.83 RELA (0.71) RELACA2CA1CA12CA7

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-5276179-A Used in photographic processing solution, chelate titration, for metallic ion shielding agent, medical drug FUJI PHOTO FILM CO., LTD. (JP) 1994-01-04 US disclosed
US-5191117-A SULFONAMIDE DERIVATIVE FUJI PHOTO FILM CO., LTD. (JP) 1993-03-02 US disclosed