SCHEMBL6869832

SCHEMBL6869832

B(Oc1ccc(CCc2ccccc2)cc1)Oc1ccc(CCc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.48
MAOB P27338 2/20 0.48
TDP1 Q9NUW8 1/20 0.46
PPARG P37231 3/20 0.44
PPARA Q07869 2/20 0.44
LTA4H P09960 3/20 0.43
FFAR1 O14842 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA7 P36544 1/20 0.43
EPHX2 P34913 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
SCHEMBL5264174 0.79 CA2 (0.52) TDP1PPARALTA4HEPHX2
SCHEMBL306550 0.78 LMNA (0.64) MAOAMAOBLTA4HEPHX2
SCHEMBL23573012 0.78 FFAR1 (0.61) MAOAMAOBPPARGPPARALTA4H
Hydrochloric Acid SCHEMBL3330629 0.78 SIGMAR1 (0.51)
SCHEMBL9145079 0.77 TDP1 (0.46) MAOBTDP1PPARA
SCHEMBL3289628 0.77 THRB (0.47) PPARGPPARA
SCHEMBL4715391 0.77 TAAR1 (0.59) MAOB
SCHEMBL8885 0.77 LTA4H (0.50) MAOAMAOBTDP1LTA4H
SCHEMBL55138 0.77 MAOB (0.72) MAOAMAOBTDP1FFAR1
SCHEMBL12506236 0.77 MAOB (0.72) MAOAMAOBTDP1FFAR1

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-1004578-B1 5-oxo-pyrrolidine-2-carboxylic acid hydroxamide derivatives PFIZER PROD INC (US) 2004-02-25 EP disclosed
US-6114361-A INHIBITORS OF MATRIX METALLOPROTEINASES AND REPROLYSIN; ADMINISTERING TO TREAT CONDITIONS WHICH CAN BE TREATED BY THE INHIBITION OF THESE ENZYMES PFIZER INC. (US) 2000-09-05 US disclosed
EP-1004578-A2 5-oxo-pyrrolidine-2-carboxylic acid hydroxamide derivatives Pfizer Products Inc. (US) 2000-05-31 EP disclosed