SCHEMBL6868239

SCHEMBL6868239

CN(C)c1cc(NC2CCC(CNC(=O)Nc3c(Cl)cccc3Cl)CC2)nc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 7/20 0.43
MCHR1 Q99705 8/20 0.42
POLB P06746 1/20 0.40
ADRA2A P08913 5/20 0.40
ACACB O00763 1/20 0.40
ACACA Q13085 1/20 0.40
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MELK Q14680 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
SCHEMBL6868236 1.00 NPY5R (0.43) NPY5RMCHR1POLBADRA2AACACB
SCHEMBL6877053 0.95 KDR (0.42) NPY5RMCHR1POLBADRA2AACACB
SCHEMBL6877062 0.95 KDR (0.42) NPY5RMCHR1POLBADRA2AACACB
SCHEMBL6463959 0.94 NPY5R (0.44) NPY5RMCHR1POLBADRA2AACACB
SCHEMBL6463955 0.94 NPY5R (0.44) NPY5RMCHR1POLBADRA2AACACB
SCHEMBL6464772 0.93 MCHR1 (0.41) NPY5RMCHR1POLBADRA2AACACB
SCHEMBL6459092 0.93 MCHR1 (0.41) NPY5RMCHR1POLBADRA2AACACB
SCHEMBL6878437 0.91 NPY5R (0.43) NPY5RMCHR1POLBADRA2AACACB
SCHEMBL6878430 0.91 NPY5R (0.43) NPY5RMCHR1POLBADRA2AACACB
SCHEMBL6456892 0.91 MEN1 (0.42) NPY5RMCHR1POLBADRA2AACACB

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