SCHEMBL6006050

SCHEMBL6006050

Cc1nc(-c2ccccc2)sc1C(=O)N1CC2CCCCCCCCCCCCCCCCCCCCCC(CC2)C1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.61
SMN1; SMN2 Q16637 6/20 0.54
ALDH1A1 P00352 6/20 0.53
MAPT P10636 4/20 0.53
KMT2A Q03164 3/20 0.53
NPSR1 Q6W5P4 2/20 0.53
LMNA P02545 2/20 0.53
MEN1 O00255 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
HTT P42858 1/20 0.53
HPGD P15428 2/20 0.51
HTR2C P28335 5/20 0.49
GAA P10253 1/20 0.49
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.46
ATM Q13315 1/20 0.46

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
SCHEMBL3456305 0.95 CNR1 (0.66) CNR1SMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL12789540 0.83 CNR1 (0.77) CNR1SMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL3400921 0.81 CNR1 (0.66) CNR1SMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL12789085 0.80 CNR1 (0.72) CNR1SMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL12790042 0.80 CNR1 (0.72) CNR1SMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL3405391 0.80 CNR1 (0.65) CNR1SMN1; SMN2ALDH1A1NPSR1LMNA
SCHEMBL3403003 0.80 CNR1 (0.65) CNR1SMN1; SMN2ALDH1A1NPSR1LMNA
SCHEMBL915960 0.76 CNR1 (0.62) CNR1SMN1; SMN2ALDH1A1MAPTNPSR1
SCHEMBL17773239 0.75 CNR1 (0.53) CNR1ALDH1A1MAPTKMT2ALMNA
SCHEMBL3454733 0.74 SIGLEC9 (0.47) CNR1ALDH1A1MAPTKMT2ALMNA

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-1615698-A2 NEW AMIDE DERIVATIVES AND PHARMACEUTICAL USE THEREOF NOVO NORDISK A/S (DK) 2006-01-18 EP disclosed
WO-2004089470-A2 NEW AMIDE DERIVATIVES AND PHARMACEUTICAL USE THEREOF NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed