SCHEMBL9209935

SCHEMBL9209935

CCOC[S+]([O-])c1nc2cnccc2s1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.35
KDM4C Q9H3R0 1/20 0.34
LTA4H P09960 1/20 0.33
LATS1 O95835 5/20 0.32
CYP2A6 P11509 3/20 0.31
LATS2 Q9NRM7 2/20 0.31
HRH3 Q9Y5N1 1/20 0.31
MYC P01106 3/20 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
SCHEMBL9272981 0.79 CYP2C9 (0.43) CYP2C9KDM4CLATS1
SCHEMBL9216533 0.75 LATS1 (0.34) CYP2C9LTA4HLATS1CYP2A6LATS2
SCHEMBL9217540 0.73 POLB (0.46) CYP2C9
SCHEMBL5848920 0.72 CYP2A6 (0.31) LTA4HCYP2A6HRH3
SCHEMBL9211319 0.69 MYC (0.40) LTA4HLATS1LATS2HRH3MYC
SCHEMBL9439707 0.69 SMN1; SMN2 (0.43)
SCHEMBL9208099 0.69 MAPK1 (0.38) CYP2C9
SCHEMBL9206730 0.68
SCHEMBL9217493 0.68 CYP1A2 (0.44) CYP2C9
SCHEMBL9208395 0.67 CHRNB2 (0.40) HRH3

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-0405976-B1 Azole derivatives and antiulcerative composition containing same MEIJI SEIKA CO (JP) 1995-04-05 EP disclosed
US-5200407-A Antisecretory agents MEIJI SEIKA KABURHIKI KAISHA (JP) 1993-04-06 US disclosed
US-5141946-A Antisecretory agents; acid resistance MEIJI SEIKA KABUSHIKI KAISHA (JP) 1992-08-25 US disclosed
US-5079255-A Nontoxic, acid stability MEIJI SEIKA KABUSHIKI KAISHA (JP) 1992-01-07 US disclosed
EP-0405976-A1 Azole derivatives and antiulcerative composition containing same MEIJI SEIKA KABUSHIKI KAISHA (JP) 1991-01-02 EP disclosed