SCHEMBL8945004

SCHEMBL8945004

CCCC1CCC(CCc2ccc(S(=O)(=O)O)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.43
MAOA P21397 1/20 0.43
CA2 P00918 3/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
NMT1 P30419 5/20 0.40
CYP2C9 P11712 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GPR84 Q9NQS5 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL9239765 0.88 NMT1 (0.45) MAOBMAOACA2NMT1CYP2C9
SCHEMBL20573232 0.85 MAOB (0.40) MAOBMAOAGPR84ALDH1A1LMNA
SCHEMBL7735405 0.85 DAO (0.41) MAOBGPR84ALDH1A1LMNA
SCHEMBL23387581 0.85 GPR84 (0.37) MAOBMAOANMT1GPR84ALDH1A1
SCHEMBL12453115 0.84 DAO (0.43) MAOBCA2ALDH1A1LMNA
SCHEMBL10899324 0.83 MAOB (0.51) MAOBMAOACYP2C9GPR84ALDH1A1
SCHEMBL10899319 0.83 MAOB (0.51) MAOBMAOACYP2C9GPR84ALDH1A1
SCHEMBL963564 0.81 KCNH2 (0.44) MAOBCA2ALDH1A1LMNAHRH3
SCHEMBL11058080 0.79 MAOB (0.57) MAOBMAOACA2CYP2C9GPR84
SCHEMBL11058086 0.79 MAOB (0.57) MAOBMAOACA2CYP2C9GPR84

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5501818-A PYRIMIDINE COMPOUNDS, IMPROVED RESPONSE SPEED WITH LESS TEMPERATURE DEPENDENCE CANON KABUSHIKI KAISHA (JP) 1996-03-26 US disclosed
EP-0347944-B1 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KK (JP) 1995-02-01 EP disclosed
EP-0347940-B1 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KK (JP) 1994-09-21 EP disclosed
US-5292453-A Fluorine containing chiral smectic liquid crystal CANON KABUSHIKI KAISHA (JP) 1994-03-08 US disclosed
EP-0347944-A2 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1989-12-27 EP disclosed
EP-0347940-A2 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1989-12-27 EP disclosed