SCHEMBL9164097

SCHEMBL9164097

ONCC1=Cc2cc(OCc3ccccc3)ccc2CC1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.49
MAOB P27338 5/20 0.46
MAOA P21397 4/20 0.46
S1PR1 P21453 1/20 0.44
S1PR3 Q99500 1/20 0.44
CYP2D6 P10635 3/20 0.44
KDM1A O60341 2/20 0.44
HRH1 P35367 1/20 0.44
ALOX5 P09917 2/20 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
SCHEMBL9158093 0.90 S1PR1 (0.54) HRH3MAOBMAOAS1PR1S1PR3
SCHEMBL9162857 0.83 MAPK14 (0.42) HRH3S1PR1S1PR3ALOX5
SCHEMBL9729866 0.79 ALOX5 (0.63) MAOBMAOAALOX5
SCHEMBL9164095 0.77 MAOA (0.51) HRH3MAOBMAOACYP2D6KDM1A
SCHEMBL9164361 0.77 ALOX5 (0.58) HRH3MAOBMAOAALOX5
SCHEMBL9162668 0.77 MAOA (0.45) HRH3MAOBMAOACYP2D6KDM1A
SCHEMBL9162672 0.77 MAOA (0.45) HRH3MAOBMAOACYP2D6KDM1A
SCHEMBL9164102 0.76 HRH3 (0.50) HRH3MAOBMAOAKDM1AALOX5
SCHEMBL9158919 0.74 LIPE (0.42) MAOBMAOA
Formamide SCHEMBL9729701 0.74 ALOX5 (0.62) MAOBMAOAALOX5

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