SCHEMBL9215570

SCHEMBL9215570

CCOC(=O)C(=O)CSc1nc2cccnc2s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
PDK1 Q15118 1/20 0.49
CYP2C9 P11712 1/20 0.47
MAPT P10636 5/20 0.44
KDM4E B2RXH2 4/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 5/20 0.43
LMNA P02545 4/20 0.43
SHMT2 P34897 1/20 0.43
HSD17B10 Q99714 3/20 0.42
ALOX5 P09917 1/20 0.42
AHR P35869 1/20 0.41
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
APEX1 P27695 1/20 0.41
RECQL P46063 1/20 0.41
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL9216519 0.88 ALDH1A1 (0.56) ALDH1A1PDK1CYP2C9MAPTKDM4E
SCHEMBL9218853 0.84 ALDH1A1 (0.55) ALDH1A1PDK1CYP2C9MAPTKDM4E
SCHEMBL2160827 0.81 MAPT (0.65) ALDH1A1CYP2C9MAPTKDM4EMEN1
SCHEMBL9213501 0.81 KDM4E (0.50) ALDH1A1PDK1CYP2C9MAPTKDM4E
SCHEMBL9209204 0.81 ALDH1A1 (0.54) ALDH1A1PDK1CYP2C9MAPTKDM4E
SCHEMBL9214665 0.81 MAPT (0.63) ALDH1A1PDK1CYP2C9MAPTMEN1
SCHEMBL9212431 0.80 ALDH1A1 (0.64) ALDH1A1PDK1MAPTKDM4EMEN1
SCHEMBL9211341 0.79 PDK1 (0.59) ALDH1A1PDK1MAPTKDM4EMEN1
SCHEMBL9217547 0.79 ALDH1A1 (0.55) ALDH1A1PDK1CYP2C9MAPTKDM4E
SCHEMBL9208442 0.79 ALDH1A1 (0.48) ALDH1A1PDK1CYP2C9MAPTKDM4E

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 3 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-5079255-A Nontoxic, acid stability MEIJI SEIKA KABUSHIKI KAISHA (JP) 1992-01-07 US disclosed