SCHEMBL8436928

SCHEMBL8436928

CCOC(=O)C(C#N)Oc1cccc(OCc2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.55
LMNA P02545 1/20 0.55
MAOB P27338 3/20 0.53
NR4A2 P43354 1/20 0.52
SMPD1 P17405 1/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
SRD5A2 P31213 1/20 0.47
GUSB P08236 1/20 0.46
SGMS2 Q8NHU3 1/20 0.46
PTPN1 P18031 1/20 0.46
LTB4R Q15722 1/20 0.46
LTB4R2 Q9NPC1 1/20 0.46
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSP90AA1 P07900 1/20 0.45

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
SCHEMBL7404469 0.86 NR4A2 (0.58) MAOBNR4A2SMPD1KMT2AMEN1
SCHEMBL27827114 0.84 SMN1; SMN2 (0.48) L3MBTL1LMNAKMT2AMEN1TSHR
SCHEMBL28165602 0.82 L3MBTL1 (0.80) L3MBTL1LMNAMAOBNR4A2SMPD1
SCHEMBL340106 0.77 MAOB (0.69) MAOBNR4A2SMPD1KMT2AMEN1
SCHEMBL13720748 0.77 PPARA (0.62) L3MBTL1LMNAMAOBNR4A2SMPD1
SCHEMBL6483631 0.77 MAOB (0.61) L3MBTL1LMNAMAOBNR4A2SMPD1
SCHEMBL28292246 0.76 MAOB (0.56) L3MBTL1LMNAMAOBNR4A2KMT2A
SCHEMBL6629953 0.75 LMNA (0.61) L3MBTL1LMNAMAOBNR4A2KMT2A
SCHEMBL2039717 0.75 MAOB (0.56) L3MBTL1LMNAMAOBNR4A2KMT2A
SCHEMBL3485036 0.75 KMT2A (0.56) L3MBTL1LMNAMAOBNR4A2SMPD1

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-5969146-A MONOAMINE OXIDASE INHIBITORS SYNTHELABO (FR) 1999-10-19 US disclosed