SCHEMBL9113864

SCHEMBL9113864

[O-][S+](Cc1ccccn1)c1ccccc1-c1ncc[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1A1 P48729 1/20 0.43
TYRO3 Q06418 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
MTOR P42345 1/20 0.38
ADK P55263 1/20 0.38
NISCH Q9Y2I1 1/20 0.38
IDO1 P14902 1/20 0.36
ADRA1A P35348 1/20 0.36
SMO Q99835 2/20 0.36
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LIN28A Q9H9Z2 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
PKM P14618 1/20 0.33
CASP6 P55212 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL4935105 0.77 MAPT (0.40) MAPTSMN1; SMN2LIN28ATDP1ALDH1A1
SCHEMBL10723167 0.76 CSNK1A1 (0.39) CSNK1A1TYRO3DYRK1BMTORADK
SCHEMBL10721669 0.76 CSNK1A1 (0.39) CSNK1A1TYRO3DYRK1BMTORADK
SCHEMBL8537274 0.75 CSNK1A1 (0.46) CSNK1A1TYRO3DYRK1BMTORADK
SCHEMBL10723536 0.73 CSNK1A1 (0.36) CSNK1A1TYRO3DYRK1BMTORADK
SCHEMBL11263547 0.72 HRH1 (0.42) MAPTSMN1; SMN2LIN28ATDP1ALDH1A1
SCHEMBL10479892 0.70 CSNK1A1 (0.34) CSNK1A1TYRO3DYRK1B
SCHEMBL6528833 0.70 NISCH (0.41) CSNK1A1TYRO3DYRK1BMTORADK
SCHEMBL9287236 0.70 NISCH (0.64) CSNK1A1TYRO3DYRK1BMTORADK
SCHEMBL8617533 0.70 CSNK1A1 (0.44) CSNK1A1TYRO3DYRK1BMTORADK

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-0652751-A1 INJECTION AND INJECTION KIT CONTAINING OMEPRAZOLE AND ITS ANALOGS. ASTRA AB (SE) 1995-05-17 EP disclosed
WO-1994002141-A1 INJECTION AND INJECTION KIT CONTAINING OMEPRAZOLE AND ITS ANALOGS ASTRA AKTIEBOLAG (SE) 1994-02-03 WO disclosed
EP-0302720-A1 Production of 2-(2-Pyridylmethylsulfinyl)-benzimidazole compounds Takeda Chemical Industries, Ltd. (JP) 1989-02-08 EP disclosed