SCHEMBL8128564

SCHEMBL8128564

CCOCCSc1nc2cc(C(F)(F)F)ccc2s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.57
DYRK1A Q13627 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
CYP1A2 P05177 3/20 0.40
CYP2D6 P10635 2/20 0.40
PPARA Q07869 1/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
STAT6 P42226 1/20 0.40
NCS1 P62166 1/20 0.40
ILK Q13418 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GPR55 Q9Y2T6 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.38
HTR1A P08908 1/20 0.38
HTR2A P28223 1/20 0.38
HTR7 P34969 1/20 0.38

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
SCHEMBL9744754 0.84 MAPT (0.46) ALOX5DYRK1AL3MBTL1CYP1A2CYP2D6
SCHEMBL9393819 0.82 ALOX5 (0.61) ALOX5DYRK1AL3MBTL1CYP1A2CYP2D6
SCHEMBL9439285 0.81 ALOX5 (0.60) ALOX5L3MBTL1CYP1A2CYP2D6PPARA
SCHEMBL19828210 0.79 ALOX5 (0.53) ALOX5DYRK1AL3MBTL1CYP1A2PPARA
SCHEMBL8133629 0.77 MAPT (0.55) ALOX5L3MBTL1CYP1A2PPARACYP3A4
SCHEMBL9443101 0.77 ALOX5 (0.64) ALOX5DYRK1AL3MBTL1CYP1A2PPARA
SCHEMBL30602944 0.76 SMN1; SMN2 (0.59) ALOX5DYRK1AL3MBTL1CYP1A2PPARA
SCHEMBL3660244 0.76 SMN1; SMN2 (0.59) ALOX5DYRK1AL3MBTL1CYP1A2PPARA
SCHEMBL9186874 0.76 ALOX5 (0.57) ALOX5DYRK1AL3MBTL1CYP1A2CYP2D6
SCHEMBL17153983 0.75 ALOX5 (0.52) ALOX5DYRK1AL3MBTL1CYP1A2PPARA

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-0452076-B1 Thiazole and imidazole derivatives and antiulcer composition containing same MEIJI SEIKA CO (JP) 2000-07-19 EP disclosed
US-5171746-A THIAZOLE AND IMIDAZOLE DERIVATIVES AND ANTIULCER COMPOSITION CONTAINING SAME MEIJI SEIKA KABUSHIKI KAISHA (JP) 1992-12-15 US disclosed
EP-0452076-A1 Thiazole and imidazole derivatives and antiulcer composition containing same MEIJI SEIKA KABUSHIKI KAISHA (JP) 1991-10-16 EP disclosed