SCHEMBL28516282

SCHEMBL28516282

CCCCCOCCCCC.NC(=O)CCCCCCC(N)=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
SOAT1 P35610 2/20 0.59
FAAH O00519 1/20 0.59
TP53 P04637 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C19 P33261 1/20 0.59
CES2 O00748 5/20 0.55
THRB P10828 1/20 0.54
HTT P42858 1/20 0.54
MAPT P10636 1/20 0.54
KDM4E B2RXH2 2/20 0.53
DGKA P23743 1/20 0.52
CES1 P23141 3/20 0.50
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
PPARG P37231 3/20 0.48
PPARD Q03181 3/20 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
SCHEMBL14389204 1.00 MEN1 (0.59) MEN1KMT2ASOAT1FAAHTP53
SCHEMBL27956888 1.00 MEN1 (0.59) MEN1KMT2ASOAT1FAAHTP53
SCHEMBL28514362 0.98 MEN1 (0.55) MEN1KMT2ASOAT1FAAHTP53
SCHEMBL3171180 0.94 CES2 (0.53) MEN1KMT2ASOAT1FAAHTP53
SCHEMBL28945727 0.94 CES2 (0.53) MEN1KMT2ASOAT1FAAHTP53
SCHEMBL30625880 0.94 MEN1 (0.57) MEN1KMT2ASOAT1FAAHTP53
SCHEMBL9312062 0.94 CES2 (0.53) MEN1KMT2ASOAT1FAAHTP53
SCHEMBL28391149 0.94 CES2 (0.53) MEN1KMT2ASOAT1FAAHTP53
SCHEMBL21815152 0.94 CES2 (0.53) MEN1KMT2ASOAT1FAAHTP53
SCHEMBL9312135 0.94 CES2 (0.53) MEN1KMT2ASOAT1FAAHTP53

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
CN-108341947-B Intrinsic flame-retardant semi-aromatic copolymerized aryl ether amide and preparation method thereof 四川大学 2021-02-02 CN disclosed