SCHEMBL9164095

SCHEMBL9164095

O=CC1=Cc2cc(OCc3ccccc3)ccc2CC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.51
MAOB P27338 7/20 0.51
HRH3 Q9Y5N1 7/20 0.48
CA2 P00918 1/20 0.46
CA5A P35218 1/20 0.46
CYP2D6 P10635 3/20 0.45
KDM1A O60341 2/20 0.45
ALOX5 P09917 1/20 0.44
HRH1 P35367 1/20 0.43

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
SCHEMBL9162384 0.92 MAOA (0.56) MAOAMAOBHRH3CA2CA5A
SCHEMBL9165973 0.90 MAOA (0.51) MAOAMAOBHRH3CA2CA5A
SCHEMBL9162668 0.84 MAOA (0.45) MAOAMAOBHRH3CA2CA5A
SCHEMBL9162672 0.84 MAOA (0.45) MAOAMAOBHRH3CA2CA5A
SCHEMBL9163107 0.81 HRH3 (0.41) MAOAMAOBHRH3ALOX5
SCHEMBL9729518 0.77 ALOX5 (0.59) MAOAMAOBCA2CA5AALOX5
SCHEMBL9164097 0.77 HRH3 (0.49) MAOAMAOBHRH3CYP2D6KDM1A
SCHEMBL9165856 0.77 MAOA (0.50) MAOAMAOBHRH3CYP2D6KDM1A
SCHEMBL9165847 0.77 MAOA (0.50) MAOAMAOBHRH3CYP2D6KDM1A
SCHEMBL9164102 0.75 HRH3 (0.50) MAOAMAOBHRH3CA2CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0408760-B1 NEW HYDROXYLAMINE DERIVATIVE FUJISAWA PHARMACEUTICAL CO (JP) 1995-03-15 EP disclosed
EP-0408760-A1 NEW HYDROXYLAMINE DERIVATIVE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-01-23 EP disclosed