SCHEMBL5233345

SCHEMBL5233345

O=C(O)N1CCCN(c2ccc(-c3ccc(Cl)cc3Cl)cn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.51
MGLL Q99685 5/20 0.48
CNR1 P21554 4/20 0.47
HSD17B10 Q99714 1/20 0.46
RET P07949 1/20 0.43
MCHR1 Q99705 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL5236075 0.96 CNR2 (0.54) CNR2MGLLCNR1HSD17B10RET
SCHEMBL5237235 0.88 MGLL (0.53) CNR2MGLLCNR1L3MBTL1RAB9A
SCHEMBL31589999 0.85 MGLL (0.63) CNR2MGLLCNR1HSD17B10RET
SCHEMBL5235945 0.82 MGLL (0.57) CNR2MGLLL3MBTL1RAB9A
SCHEMBL31589359 0.80 MGLL (0.53) CNR2MGLLRET
SCHEMBL5236215 0.80 FAAH (0.43) CNR2MGLLCNR1RETMEN1
SCHEMBL16397570 0.79 PANK3 (0.57) CNR2RAB9A
SCHEMBL31589932 0.79 CNR2 (0.64) CNR2MGLLCNR1RET
SCHEMBL5231208 0.79 SRD5A2 (0.50) CNR1MEN1RAB9AKMT2A
SCHEMBL31589940 0.79 MGLL (0.63) CNR2MGLLRET

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP claimed