SCHEMBL7069938

SCHEMBL7069938

C=CC(Cc1ccccc1)(C(=O)c1ccc(N2CCOCC2)cc1)N(CC)CC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.45
MAOB P27338 1/20 0.43
ESR1 P03372 1/20 0.42
MAPT P10636 6/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
GSK3B P49841 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALOX12 P18054 1/20 0.40
RORC P51449 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
PRKDC P78527 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
SCHEMBL1920044 0.89 SMN1; SMN2 (0.46) SMN1; SMN2MAOBESR1MAPTL3MBTL1
SCHEMBL4376965 0.83 SMN1; SMN2 (0.48) SMN1; SMN2MAOBESR1MAPTL3MBTL1
SCHEMBL1781930 0.82 SMN1; SMN2 (0.47) SMN1; SMN2MAOBESR1MAPTL3MBTL1
SCHEMBL345537 0.80 SMN1; SMN2 (0.46) SMN1; SMN2MAOBESR1MAPTL3MBTL1
SCHEMBL4223706 0.80 SMN1; SMN2 (0.43) SMN1; SMN2MAOBESR1MAPTL3MBTL1
SCHEMBL8899177 0.77 SMN1; SMN2 (0.45) SMN1; SMN2MAOBESR1MAPTL3MBTL1
SCHEMBL14003728 0.77 SMN1; SMN2 (0.51) SMN1; SMN2MAOBESR1MAPTL3MBTL1
SCHEMBL8898916 0.77 SMN1; SMN2 (0.51) SMN1; SMN2MAOBESR1MAPTL3MBTL1
Formaldehyde SCHEMBL28335498 0.77 SMN1; SMN2 (0.46) SMN1; SMN2MAOBESR1MAPTL3MBTL1
SCHEMBL10226595 0.77 SMN1; SMN2 (0.46) SMN1; SMN2MAOBESR1MAPTL3MBTL1

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-1316434-A2 Process for making weather proof and chemical-resistant outdoor signs and signs made thereby Trip Industries Holding B.V. (NL) 2003-06-04 EP disclosed