SCHEMBL3905728

SCHEMBL3905728

Cl/C=C/CN[C@@H]1CCc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.55
MAOB P27338 4/20 0.55
BCHE P06276 1/20 0.55
ADRA2B P18089 1/20 0.55
ADRA2C P18825 1/20 0.55
ACHE P22303 1/20 0.55
ADRA1A P35348 1/20 0.55
HTR6 P50406 1/20 0.55
PDPK1 O15530 1/20 0.51
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
FADS1 O60427 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HTR1A P08908 1/20 0.43
SLC18A3 Q16572 1/20 0.42
KDM1A O60341 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
TAS1R2 Q8TE23 1/20 0.42
HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL3890762 1.00 MAOA (0.55) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL30826849 1.00 MAOA (0.55) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL3895382 1.00 MAOA (0.55) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL13631292 1.00 MAOA (0.55) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL3890758 1.00 MAOA (0.55) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL3905731 1.00 MAOA (0.55) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL13618846 1.00 MAOA (0.55) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL3895381 1.00 MAOA (0.55) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL13618833 0.84 MAOA (0.59) MAOAMAOBBCHEADRA2BADRA2C
SCHEMBL13618838 0.84 MAOA (0.59) MAOAMAOBBCHEADRA2BADRA2C

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
CN-113884603-A Method for determining content of genotoxic impurities in rasagiline mesylate by liquid chromatography-mass spectrometry 常州市第四制药厂有限公司 2022-01-04 CN disclosed
US-7619117-B1 Rasagiline formulations and processes for their preparation TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2009-11-17 US disclosed
US-7619117-B1 Rasagiline formulations and processes for their preparation TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2009-11-17 US disclosed
US-7598420-B1 Rasagiline formulations and processes for their preparation TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2009-10-06 US disclosed
US-7572834-B1 Rasagiline formulations and processes for their preparation TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2009-08-11 US disclosed
US-7572834-B1 Rasagiline formulations and processes for their preparation TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2009-08-11 US disclosed