SCHEMBL6878308

SCHEMBL6878308

CSc1ncccc1C(=O)NC[C@H]1CC[C@@H](Nc2cc(N(C)C)c3ccccc3n2)CC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.47
NPY5R Q15761 3/20 0.47
ADRA2A P08913 2/20 0.47
RAB9A P51151 1/20 0.43
HPGD P15428 1/20 0.42
ATM Q13315 1/20 0.42
ACACB O00763 5/20 0.42
ACACA Q13085 4/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL6877359 0.93 MCHR1 (0.45) MCHR1NPY5RADRA2AACACBACACA
SCHEMBL6868859 0.91 HSD11B1 (0.47) MCHR1NPY5RADRA2AACACBACACA
SCHEMBL6878501 0.89 RAB9A (0.56) MCHR1NPY5RADRA2ARAB9AMEN1
SCHEMBL6878491 0.89 RAB9A (0.56) MCHR1NPY5RADRA2ARAB9AMEN1
Hydrochloric Acid SCHEMBL6461571 0.85 MAPK8 (0.46) MCHR1NPY5RADRA2AACACBACACA
Hydrochloric Acid SCHEMBL6461570 0.85 MAPK8 (0.46) MCHR1NPY5RADRA2AACACBACACA
SCHEMBL6878852 0.85 MCHR1 (0.51) MCHR1NPY5RADRA2AACACBACACA
SCHEMBL6875316 0.85 MCHR1 (0.48) MCHR1NPY5RADRA2AACACBACACA
SCHEMBL6875313 0.85 MCHR1 (0.48) MCHR1NPY5RADRA2AACACBACACA
SCHEMBL6878858 0.85 MCHR1 (0.51) MCHR1NPY5RADRA2AACACBACACA

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-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP disclosed