SCHEMBL8548169

SCHEMBL8548169

O=S(=O)(O)OCc1cc[c]cc1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.43
CA9 Q16790 4/20 0.43
CA1 P00915 4/20 0.39
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.31
CA12 O43570 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
Water SCHEMBL11053215 0.81 CA2 (0.61) CA2CA9CA1KMT2ATSHR
SCHEMBL2687935 0.80 CA1 (0.43) CA2CA9CA1CA12
SCHEMBL4334012 0.79 CA2 (0.43) CA2CA9CA1KMT2ATSHR
SCHEMBL6212916 0.78 CA2 (0.52) CA2CA9CA1KMT2A
SCHEMBL332355 0.78 CA2 (0.63) CA2CA9CA1KMT2ATSHR
Ammonia Solution, Strong SCHEMBL28824538 0.77 CA2 (0.61) CA2CA9CA1KMT2ATSHR
Ammonia Solution, Strong SCHEMBL28824537 0.77 CA2 (0.61) CA2CA9CA1KMT2ATSHR
SCHEMBL6429397 0.77 CA2 (0.50) CA2CA9CA1KMT2ATSHR
Hydrogen Sulfide SCHEMBL12483354 0.77 CA2 (0.61) CA2CA9CA1KMT2ATSHR
Ammonia Solution, Strong SCHEMBL27830775 0.77 CA2 (0.61) CA2CA9CA1KMT2ATSHR

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
EP-0659747-B1 Branched aminothiazole derivatives process for their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1998-04-01 EP claimed
US-5821255-A REGULATING THE SECRETION OF CORTICOTROPIN, BETA-ENDORPHIN OR PEPTIDES DERIVED FROM PROOPIOMELANOCORTIN SANOFI (FR) 1998-10-13 US disclosed
EP-0659747-B1 Branched aminothiazole derivatives process for their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1998-04-01 EP disclosed
US-5602132-A USEFUL IN TREATMENT OF PATHOLOGIES INVOLVING CORTICOTROPIN RELEASING FACTOR SANOFI (FR) 1997-02-11 US disclosed
EP-0659747-A1 Branched aminothiazole derivatives process for their preparation and pharmaceutical compositions containing them SANOFI (FR) 1995-06-28 EP disclosed