SCHEMBL6877152

SCHEMBL6877152

COc1ccc2ccccc2c1CN[C@H]1CC[C@@H](Nc2cc(N(C)C)c3ccccc3n2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.51
KDM1A O60341 1/20 0.48
MAOA P21397 1/20 0.48
APP P05067 2/20 0.43
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
DPP8 Q6V1X1 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
KMT2A Q03164 4/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
ADRA2A P08913 1/20 0.40
USP2 O75604 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL6877157 1.00 MCHR1 (0.51) MCHR1KDM1AMAOAAPPBCHE
SCHEMBL6878019 0.91 MCHR1 (0.53) MCHR1KDM1AMAOAAPPBCHE
SCHEMBL6878027 0.91 MCHR1 (0.53) MCHR1KDM1AMAOAAPPBCHE
SCHEMBL6877318 0.89 MCHR1 (0.44) MCHR1KDM1AMAOAAPPBCHE
SCHEMBL6877323 0.89 MCHR1 (0.44) MCHR1KDM1AMAOAAPPBCHE
SCHEMBL6873635 0.86 MCHR1 (0.51) MCHR1KDM1AMAOAAPPBCHE
SCHEMBL6873630 0.86 MCHR1 (0.51) MCHR1KDM1AMAOAAPPBCHE
SCHEMBL6879016 0.86 MCHR1 (0.51) MCHR1APPBCHEACHEKMT2A
SCHEMBL6879011 0.86 MCHR1 (0.51) MCHR1APPBCHEACHEKMT2A
SCHEMBL6877379 0.84 MCHR1 (0.50) MCHR1APPBCHEACHEPOLB

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