SCHEMBL6902524

SCHEMBL6902524

C=Cc1cc(NC(=O)Oc2cnn(-c3ccc(Cl)cc3)c2C)ccc1N1CCC(N2CCOCC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 7/20 0.46
EGFR P00533 4/20 0.41
EPHX2 P34913 2/20 0.39
FGFR1 P11362 2/20 0.39
KCNH2 Q12809 1/20 0.38
HTT P42858 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL6902788 0.94 MCHR1 (0.45) MCHR1EGFREPHX2KCNH2HTT
SCHEMBL6897156 0.92 MAPT (0.46) MCHR1EPHX2FGFR1HTTKMT2A
SCHEMBL6901821 0.90 MCHR1 (0.44) MCHR1EGFREPHX2FGFR1KCNH2
SCHEMBL6901950 0.90 MCHR1 (0.44) MCHR1EGFREPHX2FGFR1KCNH2
SCHEMBL7054601 0.88 MCHR1 (0.43) MCHR1EGFREPHX2FGFR1HTT
SCHEMBL6052405 0.88 MCHR1 (0.48) MCHR1EPHX2FGFR1HTTKMT2A
SCHEMBL6902620 0.88 MCHR1 (0.42) MCHR1EGFREPHX2FGFR1KCNH2
SCHEMBL6896762 0.87 MAPT (0.44) MCHR1HTTKMT2AMAPTSMN1; SMN2
SCHEMBL6901688 0.86 MCHR1 (0.46) MCHR1HTTKMT2AMAPTSMN1; SMN2
SCHEMBL6902446 0.84 NPY2R (0.47) MCHR1HTTKMT2AMAPTSMN1; SMN2

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-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP claimed