SCHEMBL4065480

SCHEMBL4065480

CC(Br)Oc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
CYP1A2 P05177 1/20 0.56
PTGS1 P23219 1/20 0.56
SLC6A2 P23975 1/20 0.56
CYP2C19 P33261 1/20 0.56
PTGS2 P35354 1/20 0.56
SLC6A3 Q01959 1/20 0.56
HIF1A Q16665 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
MAOB P27338 4/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
MAOA P21397 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PPARG P37231 2/20 0.54
PPARA Q07869 2/20 0.54
BCHE P06276 3/20 0.51
NR4A1 P22736 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
SCHEMBL8634028 0.85 LMNA (0.60) LMNAL3MBTL1CYP1A2PTGS1SLC6A2
SCHEMBL6616547 0.82 LMNA (0.56) LMNAL3MBTL1CYP1A2PTGS1SLC6A2
SCHEMBL7288111 0.82 LMNA (0.56) LMNAL3MBTL1CYP1A2PTGS1SLC6A2
SCHEMBL9451329 0.82 LMNA (0.61) LMNAL3MBTL1CYP1A2PTGS1SLC6A2
SCHEMBL11579600 0.82 MAOB (0.59) LMNAL3MBTL1CYP1A2PTGS1SLC6A2
SCHEMBL27367676 0.80 LMNA (0.82) LMNAL3MBTL1CYP1A2PTGS1SLC6A2
SCHEMBL339813 0.80 LMNA (0.82) LMNAL3MBTL1CYP1A2PTGS1SLC6A2
SCHEMBL27378584 0.80 PPARG (0.56) LMNAL3MBTL1CYP1A2PTGS1SLC6A2
SCHEMBL6617980 0.80 RAB9A (0.49) LMNAL3MBTL1HDAC6MAOBRAB9A
SCHEMBL9406682 0.79 LMNA (0.58) LMNAL3MBTL1CYP1A2PTGS1SLC6A2

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-2051964-A2 FATTY ACID AMIDE HYDROLASE INHIBITORS University of Connecticut (US) 2009-04-29 EP disclosed
WO-2008013963-A2 FATTY ACID AMIDE HYDROLASE INHIBITORS UNIVERSITY OF CONNECTICUT (US) 2008-01-31 WO disclosed