SCHEMBL6875436

SCHEMBL6875436

Cc1cccc(C)c1NC(=O)NCC1CCC(Nc2cc(N(C)C)c3ccccc3n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 9/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
ADRA2A P08913 6/20 0.40
NPY5R Q15761 3/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGER4 P35408 1/20 0.38
ADRA1A P35348 1/20 0.37
HRH1 P35367 1/20 0.37
HTR2B P41595 1/20 0.37
POLB P06746 1/20 0.36
ACACB O00763 1/20 0.36
ACACA Q13085 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
SCHEMBL6875428 1.00 MCHR1 (0.43) MCHR1KDM4ELMNASMN1; SMN2TDP1
SCHEMBL6464423 0.94 MCHR1 (0.40) MCHR1KDM4ELMNASMN1; SMN2TDP1
SCHEMBL6877053 0.94 KDR (0.42) MCHR1KDM4ELMNASMN1; SMN2ADRA2A
SCHEMBL6464416 0.94 MCHR1 (0.40) MCHR1KDM4ELMNASMN1; SMN2TDP1
SCHEMBL6877062 0.94 KDR (0.42) MCHR1KDM4ELMNASMN1; SMN2ADRA2A
SCHEMBL6464055 0.94 MCHR1 (0.42) MCHR1KDM4ELMNASMN1; SMN2ADRA2A
SCHEMBL6464046 0.94 MCHR1 (0.42) MCHR1KDM4ELMNASMN1; SMN2ADRA2A
SCHEMBL6467746 0.93 MCHR1 (0.40) MCHR1KDM4ELMNASMN1; SMN2TDP1
SCHEMBL6467739 0.93 MCHR1 (0.40) MCHR1KDM4ELMNASMN1; SMN2TDP1
SCHEMBL6463927 0.93 MCHR1 (0.39) MCHR1KDM4ELMNASMN1; SMN2TDP1

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