SCHEMBL5237002

SCHEMBL5237002

CNC1(C(C)=O)CN(c2ccc(-c3ccc(Cl)cc3Cl)cn2)CCCN1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.41
KCNH2 Q12809 3/20 0.41
MCHR1 Q99705 1/20 0.40
CNR2 P34972 6/20 0.40
CNR1 P21554 11/20 0.38
RET P07949 1/20 0.35

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
SCHEMBL5231072 0.95 MCHR1 (0.41) DGAT1KCNH2MCHR1CNR2CNR1
SCHEMBL5234753 0.91 DGAT1 (0.41) DGAT1KCNH2MCHR1CNR2CNR1
SCHEMBL5236755 0.84 MGLL (0.41) DGAT1KCNH2MCHR1CNR2
SCHEMBL5237009 0.82 DGAT1 (0.39) DGAT1KCNH2MCHR1CNR2CNR1
SCHEMBL5239862 0.82 SRD5A2 (0.39) MCHR1CNR1
SCHEMBL5238842 0.81 EGLN1 (0.43) DGAT1MCHR1CNR1RET
SCHEMBL5236952 0.81 EGLN1 (0.46) KCNH2MCHR1CNR2CNR1
SCHEMBL5237578 0.80 KDM4E (0.43) DGAT1KCNH2CNR2
SCHEMBL5233791 0.80 PANK3 (0.41)
SCHEMBL5233010 0.79 MGLL (0.44) DGAT1KCNH2

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