SCHEMBL9864598

SCHEMBL9864598

CN(C)c1ccc(Oc2ccc(C=CC(N)=O)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.60
MAOB P27338 6/20 0.57
MAPT P10636 4/20 0.51
MAOA P21397 4/20 0.51
KMT2A Q03164 3/20 0.51
TLR9 Q9NR96 2/20 0.51
MEN1 O00255 2/20 0.51
MAPK1 P28482 2/20 0.51
USP2 O75604 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48

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
SCHEMBL13748345 0.90 HSD17B3 (0.72) HSD17B3MAOBMAPTMAOAKMT2A
SCHEMBL2218287 0.90 HSD17B3 (0.72) HSD17B3MAOBMAPTMAOAKMT2A
SCHEMBL13067861 0.85 HSD17B3 (0.66) HSD17B3MAOBMAPTMAOAKMT2A
SCHEMBL9864946 0.82 MAOB (0.54) MAOBMAPTMAOAKMT2AMEN1
SCHEMBL10031851 0.81 RELA (0.63) HSD17B3MAOBMAPTKMT2AMEN1
SCHEMBL9865069 0.80 KMT2A (0.64) MAPTKMT2AMEN1L3MBTL1NPC1
SCHEMBL9864003 0.79 CYP1A2 (0.56) MAOBMAPTMAOAKMT2AMEN1
SCHEMBL1383345 0.76 F3 (0.72) MAOBMAPTMAOAKMT2AMEN1
SCHEMBL2009524 0.76 F3 (0.72) MAOBMAPTMAOAKMT2AMEN1
SCHEMBL8409071 0.76 F3 (0.77) HSD17B3MAOBMAPTMAOAKMT2A

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-0409565-A1 Rubber composition useful for tires SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-23 EP disclosed