SCHEMBL1083115

SCHEMBL1083115

CC(C)(C)C(=O)Oc1cccc(C=O)c1.CC(C)(C)C(=O)Oc1cccc(CBr)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.46
MAOA P21397 7/20 0.45
MAOB P27338 7/20 0.45
POLB P06746 2/20 0.43
ALDH1A1 P00352 1/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
BLM P54132 1/20 0.41
MCL1 Q07820 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SRC P12931 1/20 0.40

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
SCHEMBL1033055 0.89 ELANE (0.51) ELANE
SCHEMBL1035304 0.88 POLB (0.52) ELANEMAOAMAOBPOLBALDH1A1
SCHEMBL1035696 0.76 ELANE (0.53) ELANESMN1; SMN2
SCHEMBL413431 0.75 ELANE (0.47) ELANETDP1
SCHEMBL29607567 0.73 ALDH1A1 (0.54) MAOAMAOBALDH1A1NPC1RAB9A
SCHEMBL190072 0.73 ALDH1A1 (0.54) MAOAMAOBALDH1A1NPC1RAB9A
SCHEMBL17128648 0.73 ACHE (0.39)
SCHEMBL3407357 0.73 CYP3A4 (0.58) KMT2AMEN1
SCHEMBL31139357 0.72 MAOB (0.74) MAOAMAOBALDH1A1NPC1RAB9A
SCHEMBL528206 0.72 MAOA (0.48) MAOAMAOBPOLBALDH1A1NPC1

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-2276738-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS Pfizer Inc. (US) 2011-01-26 EP disclosed
WO-2009127943-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2009-10-22 WO disclosed