SCHEMBL7657442

SCHEMBL7657442

CN(C)CC1=Cc2ncc(NC(=O)c3ccc(-c4ccccc4)c(Cl)c3)cc2CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 13/20 0.51
PRKD3 O94806 2/20 0.43
MAP4K4 O95819 2/20 0.43
EGFR P00533 2/20 0.43
NTRK1 P04629 2/20 0.43
AXL P30530 2/20 0.43
FLT4 P35916 2/20 0.43
FLT3 P36888 2/20 0.43
CLK2 P49760 2/20 0.43
MAP4K2 Q12851 2/20 0.43
CAMK2B Q13554 2/20 0.43
CAMK2G Q13555 2/20 0.43
CAMK2D Q13557 2/20 0.43
PTK6 Q13882 2/20 0.43
NTRK3 Q16288 2/20 0.43
PKN2 Q16513 2/20 0.43
MINK1 Q8N4C8 2/20 0.43
PRKD2 Q9BZL6 2/20 0.43
SLK Q9H2G2 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43

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
SCHEMBL5582563 0.89 MCHR1 (0.58) MCHR1TRPV1KCNQ3KCNQ2
SCHEMBL5582718 0.84 MCHR1 (0.71) MCHR1KCNQ3KCNQ2
SCHEMBL5582684 0.76 MCHR1 (0.76) MCHR1
SCHEMBL5582702 0.72 MCHR1 (0.82) MCHR1
SCHEMBL7657444 0.72 MCHR1 (0.45) MCHR1KDM4EALDH1A1MAPT
SCHEMBL5994627 0.68 MCHR1 (1.00) MCHR1
SCHEMBL23226736 0.67 DEGS1 (0.64) KDM4EALDH1A1MAPT
SCHEMBL5582611 0.67 MCHR1 (0.80) MCHR1
SCHEMBL5583904 0.66 MCHR1 (0.69) MCHR1
SCHEMBL5582546 0.66 MCHR1 (0.80) MCHR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218336-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP claimed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 WO claimed
EP-1218336-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 WO disclosed