SCHEMBL6876284

SCHEMBL6876284

Cc1ccccc1CNC(=S)NC1CCC(Nc2nc3c(c(N(C)C)n2)CCCC3)CC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.41
MCHR1 Q99705 9/20 0.39
ADRA2A P08913 8/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HRH1 P35367 5/20 0.38
HTR2B P41595 5/20 0.38
ADRA1A P35348 3/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
ALPL P05186 1/20 0.36
HTR1A P08908 1/20 0.36
NPY5R Q15761 1/20 0.36

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
SCHEMBL6876280 1.00 MEN1 (0.42) MEN1KMT2ALMNAMCHR1ADRA2A
SCHEMBL6877441 0.91 GAA (0.47) MEN1KMT2ALMNAMCHR1ADRA2A
SCHEMBL6867662 0.91 MEN1 (0.54) MEN1KMT2ALMNAMCHR1ADRA2A
SCHEMBL6877436 0.91 GAA (0.47) MEN1KMT2ALMNAMCHR1ADRA2A
SCHEMBL6867670 0.91 MEN1 (0.54) MEN1KMT2ALMNAMCHR1ADRA2A
SCHEMBL6872137 0.90 MCHR1 (0.41) MEN1KMT2ALMNAMCHR1ADRA2A
SCHEMBL6872140 0.90 MCHR1 (0.41) MEN1KMT2ALMNAMCHR1ADRA2A
SCHEMBL6876785 0.89 KMT2A (0.58) MEN1KMT2ALMNAMCHR1ADRA2A
SCHEMBL6876780 0.89 KMT2A (0.58) MEN1KMT2ALMNAMCHR1ADRA2A
SCHEMBL6880792 0.89 MCHR1 (0.42) MCHR1ADRA2AHRH1HTR2BADRA1A

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