SCHEMBL28045924

SCHEMBL28045924

COc1ccc(NC(=O)CC(C)=O)c(OC)c1Cl

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.63
KMT2A Q03164 5/20 0.63
ALDH1A1 P00352 3/20 0.63
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 1/20 0.43
HTT P42858 1/20 0.42
USP2 O75604 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL7133200 0.82 ALDH1A1 (0.55) MEN1KMT2AALDH1A1SMN1; SMN2USP2
SCHEMBL28045985 0.80 MEN1 (0.60) MEN1KMT2AALDH1A1SMN1; SMN2NPSR1
SCHEMBL28046011 0.79 ALDH1A1 (0.55) MEN1KMT2AALDH1A1HTTUSP2
SCHEMBL13580638 0.78 ALDH1A1 (0.53) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL7603112 0.78 KMT2A (0.54) MEN1KMT2AALDH1A1MAPK1POLB
SCHEMBL10624511 0.78 ALDH1A1 (0.78) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL8824794 0.78 ALDH1A1 (1.00) MEN1KMT2AALDH1A1SMN1; SMN2NPSR1
SCHEMBL2912176 0.77 MEN1 (0.54) MEN1KMT2AALDH1A1HTTUSP2
SCHEMBL7134009 0.77 ALDH1A1 (0.68) MEN1KMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL28045982 0.77 KMT2A (0.56) MEN1KMT2AALDH1A1SMN1; SMN2HTT

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
CN-105143353-B Disazo pigment composition and method for producing same 东洋油墨SC控股株式会社 2017-03-15 CN disclosed
CN-105143353-A Disazo pigment composition and method for producing same TOYO INK SC HOLDINGS CO LTD 2015-12-09 CN disclosed