SCHEMBL6901950

SCHEMBL6901950

Cc1c(OC(=O)Nc2ccc(N3CCC(N4CCOCC4)CC3)c(Br)c2)cnn1-c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 5/20 0.44
EPHX2 P34913 2/20 0.40
FGFR1 P11362 3/20 0.39
ACP1 P24666 2/20 0.39
HTT P42858 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
EGFR P00533 1/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KCNH2 Q12809 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
SCHEMBL6901167 0.94 MCHR1 (0.44) MCHR1EPHX2ACP1HTTKMT2A
SCHEMBL6897156 0.93 MAPT (0.46) MCHR1EPHX2FGFR1HTTKMT2A
SCHEMBL6901821 0.91 MCHR1 (0.44) MCHR1EPHX2FGFR1HTTKMT2A
SCHEMBL6895056 0.90 MAPT (0.43) MCHR1FGFR1ACP1MAPTEGFR
SCHEMBL6902524 0.90 MCHR1 (0.46) MCHR1EPHX2FGFR1HTTKMT2A
SCHEMBL7054601 0.90 MCHR1 (0.43) MCHR1EPHX2FGFR1HTTKMT2A
SCHEMBL6902620 0.89 MCHR1 (0.42) MCHR1EPHX2FGFR1HTTKMT2A
SCHEMBL6896762 0.88 MAPT (0.44) MCHR1HTTKMT2AMAPTSMN1; SMN2
SCHEMBL6052252 0.88 MCHR1 (0.46) MCHR1EPHX2FGFR1HTTKMT2A
Water SCHEMBL6052454 0.87 MCHR1 (0.45) MCHR1EPHX2FGFR1HTTKMT2A

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