SCHEMBL7977321

SCHEMBL7977321

CC(C)n1c2ccccc2c2cc(NC(=O)N3CCOCC3)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 16/20 1.00
KDM4E B2RXH2 3/20 0.72
NPC1 O15118 3/20 0.72
ALDH1A1 P00352 3/20 0.72
RAB9A P51151 3/20 0.72
MEN1 O00255 3/20 0.72
MAPT P10636 3/20 0.72
KMT2A Q03164 3/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
LMNA P02545 1/20 0.72
HPGD P15428 1/20 0.72
TP53 P04637 1/20 0.57
GAA P10253 1/20 0.54
HTT P42858 1/20 0.54
REV1 Q9UBZ9 1/20 0.54

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
SCHEMBL7974783 0.88 NPY5R (1.00) NPY5RKDM4ENPC1ALDH1A1RAB9A
SCHEMBL7963464 0.84 NPY5R (1.00) NPY5RKDM4ENPC1ALDH1A1RAB9A
SCHEMBL7963462 0.83 NPY5R (1.00) NPY5RKDM4ENPC1ALDH1A1RAB9A
SCHEMBL29434775 0.79 NPY5R (1.00) NPY5RKDM4ENPC1ALDH1A1RAB9A
SCHEMBL6826732 0.79 NPY5R (1.00) NPY5RKDM4ENPC1ALDH1A1RAB9A
SCHEMBL1594119 0.79 NPY5R (0.72) NPY5RKDM4ENPC1MEN1MAPT
SCHEMBL6829168 0.78 NPY5R (1.00) NPY5RKDM4ENPC1ALDH1A1RAB9A
SCHEMBL7963513 0.77 MAPT (0.83) NPY5RKDM4ENPC1ALDH1A1RAB9A
SCHEMBL1593465 0.75 NPY5R (1.00) NPY5RKDM4EMEN1MAPTKMT2A
SCHEMBL178526 0.74 NPC1 (0.71) NPY5RKDM4ENPC1ALDH1A1RAB9A

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
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO claimed
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed