SCHEMBL7285169

SCHEMBL7285169

BrCCCOc1cccc(OCc2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.62
BCHE P06276 3/20 0.54
CYP4F2 P78329 1/20 0.54
CYP4A11 Q02928 1/20 0.54
MAOA P21397 1/20 0.53
NR4A2 P43354 1/20 0.53
ALOX5 P09917 1/20 0.51
LCK P06239 1/20 0.50

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
SCHEMBL1172204 0.95 MAOB (0.60) MAOBBCHECYP4F2CYP4A11MAOA
SCHEMBL6507891 0.91 MAOB (0.64) MAOBBCHECYP4F2CYP4A11MAOA
SCHEMBL4216340 0.87 LMNA (0.60) MAOBBCHEMAOANR4A2ALOX5
SCHEMBL17911614 0.85 KCNA3 (0.48) MAOBMAOA
SCHEMBL1268719 0.85 MAOB (0.81) MAOBBCHECYP4F2CYP4A11MAOA
SCHEMBL19281462 0.85 CYP4F2 (0.66) MAOBBCHECYP4F2CYP4A11MAOA
SCHEMBL5162745 0.84 MAOB (0.68) MAOBBCHECYP4F2CYP4A11MAOA
SCHEMBL8060184 0.83 MAOB (0.62) MAOBBCHECYP4F2CYP4A11MAOA
SCHEMBL24648592 0.82 KDM4E (0.56)
SCHEMBL1172641 0.82 MGLL (0.59) MAOBBCHEMAOANR4A2

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-0824098-B1 4-hydroxy-piperidine derivatives HOFFMANN LA ROCHE (CH) 2001-10-31 EP disclosed
US-5889026-A 4-hydroxy-piperodine derivatives HOFFMANN-LA ROCHE INC. (US) 1999-03-30 US disclosed
EP-0824098-A1 4-hydroxy-piperidine derivatives F. HOFFMANN-LA ROCHE AG (CH) 1998-02-18 EP disclosed