SCHEMBL6868937

SCHEMBL6868937

Cc1ccc(N(C(=O)O)[C@H]2CC[C@@H](Nc3cc(N(C)C)c4ccccc4n3)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
MCHR1 Q99705 11/20 0.44
ADRA2A P08913 9/20 0.42
TP53 P04637 3/20 0.38
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
CCNK O75909 2/20 0.38
CCNA2 P20248 2/20 0.38
CDK2 P24941 2/20 0.38
CDK12 Q9NYV4 2/20 0.38
HTR1A P08908 1/20 0.37
ADRA1A P35348 1/20 0.37
HRH1 P35367 1/20 0.37
HTR2B P41595 1/20 0.37
NPY5R Q15761 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL6868943 1.00 SMN1; SMN2 (0.44) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6878585 0.91 MCHR1 (0.43) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6878575 0.91 MCHR1 (0.43) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6876704 0.89 MCHR1 (0.43) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6876711 0.89 MCHR1 (0.43) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6877727 0.85 MCHR1 (0.46) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6877718 0.85 MCHR1 (0.46) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6867658 0.84 MCHR1 (0.48) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6867655 0.84 MCHR1 (0.48) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A
SCHEMBL6878756 0.84 MCHR1 (0.50) SMN1; SMN2KDM4ELMNAMCHR1ADRA2A

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