SCHEMBL6877940

SCHEMBL6877940

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

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 13/20 0.46
EPHX2 P34913 2/20 0.46
MCHR1 Q99705 7/20 0.45
ADRA2A P08913 6/20 0.44
HTR1A P08908 1/20 0.42
ADRA1A P35348 1/20 0.42
HRH1 P35367 1/20 0.42
HTR2B P41595 1/20 0.42
NPY5R Q15761 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
SCHEMBL6877947 1.00 EPHX1 (0.46) EPHX1EPHX2MCHR1ADRA2AHTR1A
SCHEMBL6875427 0.97 MCHR1 (0.45) EPHX1EPHX2MCHR1ADRA2AHTR1A
SCHEMBL6875432 0.97 MCHR1 (0.45) EPHX1EPHX2MCHR1ADRA2AHTR1A
SCHEMBL6876994 0.87 KDM4E (0.50) MCHR1ADRA2A
SCHEMBL6877000 0.87 KDM4E (0.50) MCHR1ADRA2A
SCHEMBL6874577 0.83 LMNA (0.52) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL6874583 0.83 LMNA (0.52) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL6877613 0.82 MCHR1 (0.48) EPHX1EPHX2MCHR1ADRA2AHTR1A
SCHEMBL6868157 0.82 MCHR1 (0.49) EPHX1MCHR1ADRA2AHTR1AADRA1A
SCHEMBL6868164 0.82 MCHR1 (0.49) EPHX1MCHR1ADRA2AHTR1AADRA1A

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