SCHEMBL5839167

SCHEMBL5839167

Cc1cccc(C)c1NC(Nc1c(C)cccc1C)C(C)(C)c1ccccn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
FDPS P14324 2/20 0.35
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
SCN8A Q9UQD0 2/20 0.34
HTT P42858 2/20 0.34
SLC40A1 Q9NP59 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL5838893 0.84 SMN1; SMN2 (0.35) SMN1; SMN2L3MBTL1FDPSNOS3NOS1
SCHEMBL5840008 0.82 SLC40A1 (0.39) SMN1; SMN2L3MBTL1SLC40A1LMNAHDAC6
SCHEMBL5838176 0.73 SMN1; SMN2 (0.42) SMN1; SMN2L3MBTL1ALDH1A1LMNAHDAC6
SCHEMBL28731708 0.72 KDM4E (0.46) SCN8AKDM4E
SCHEMBL5840135 0.71 SMN1; SMN2 (0.40) SMN1; SMN2L3MBTL1HTTALDH1A1LMNA
SCHEMBL20809866 0.70 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
Hydrochloric Acid SCHEMBL28731715 0.70 KDM4E (0.44) SCN8AKDM4E
SCHEMBL5839663 0.69 SMN1; SMN2 (0.48) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL28341098 0.67 L3MBTL1 (0.47) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL19862563 0.67 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL1ALDH1A1LMNAHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6992034-B2 Catalyst component for olefin polymerization FORMOSA PLASTICS CORPORATION, U.S.A. (US) 2006-01-31 US disclosed
US-20050009690-A1 Catalyst component for olefin polymerization FORMOSA PLASTICS CORPORATIONS, U.S.A. 2005-01-13 US disclosed