SCHEMBL9481978

SCHEMBL9481978

Cc1ccccc1CN(CCOC(=O)c1ccc(Cl)cc1)Cc1ccccc1C.O=[N+]([O-])c1cccc(S(=O)(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 2/20 0.50
HTT P42858 2/20 0.50
RECQL P46063 1/20 0.50
MAPT P10636 4/20 0.49
MAPK1 P28482 2/20 0.49
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TP53 P04637 1/20 0.40
CXCR3 P49682 1/20 0.39
EPHX2 P34913 1/20 0.39
GPR17 Q13304 2/20 0.39
MLYCD O95822 1/20 0.38
P2RY2 P41231 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL9482301 0.93 SMN1; SMN2 (0.52) SMN1; SMN2LMNAHTTRECQLMAPT
SCHEMBL9480184 0.91 MAPT (0.49) SMN1; SMN2LMNAHTTRECQLMAPT
SCHEMBL8986319 0.85 MAPT (0.43) SMN1; SMN2LMNAHTTRECQLMAPT
SCHEMBL9728680 0.85 SMN1; SMN2 (0.50) SMN1; SMN2LMNAHTTRECQLMAPT
SCHEMBL9481791 0.81 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHTTRECQLMAPT
SCHEMBL8986374 0.81 MAPT (0.42) SMN1; SMN2LMNAHTTRECQLMAPT
SCHEMBL9482049 0.79 MAPT (0.42) SMN1; SMN2LMNAHTTRECQLMAPT
SCHEMBL9479948 0.78 MAPT (0.41) SMN1; SMN2LMNAHTTRECQLMAPT
SCHEMBL8970666 0.77 SMN1; SMN2 (0.44) SMN1; SMN2LMNAHTTRECQLMAPT
SCHEMBL9729529 0.77 SMN1; SMN2 (0.48) SMN1; SMN2LMNAHTTRECQLMAPT

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
US-5194472-A Low fusion temperature, improved polyester compatibility; toners for copiers EASTMAN KODAK COMPANY (US) 1993-03-16 US disclosed