SCHEMBL25609474

SCHEMBL25609474

COCCCNS(=O)(=O)/C(C#N)=C/c1ccc(-c2ccc3cc(N4CCOCC4)ccc3c2)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.47
ALDH1A1 P00352 9/20 0.37
KDM4E B2RXH2 5/20 0.37
KMT2A Q03164 4/20 0.37
GAA P10253 4/20 0.37
MEN1 O00255 3/20 0.37
HPGD P15428 3/20 0.37
MAPT P10636 3/20 0.37
HTT P42858 2/20 0.37
USP2 O75604 2/20 0.37
SYK P43405 2/20 0.37
THRB P10828 1/20 0.37
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CASP1 P29466 2/20 0.36
CASP7 P55210 2/20 0.36
NSD2 O96028 1/20 0.36
TSHR P16473 1/20 0.36
CASP6 P55212 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL18220165 0.95 APP (0.48) APPALDH1A1KDM4EKMT2AGAA
SCHEMBL26229681 0.89 APP (0.43) APPALDH1A1KDM4EKMT2AGAA
SCHEMBL18220161 0.87 APP (0.47) APPALDH1A1KDM4EKMT2AGAA
SCHEMBL18220153 0.86 APP (0.47) APPALDH1A1KMT2AMEN1MAPT
SCHEMBL25605989 0.85 APP (0.61) APPALDH1A1KDM4EKMT2AGAA
SCHEMBL25610090 0.84 APP (0.46) APPALDH1A1KDM4EKMT2AGAA
SCHEMBL18220272 0.83 APP (0.37) APPALDH1A1KDM4EKMT2AMEN1
SCHEMBL17120674 0.83 MAPT (0.37) APPALDH1A1KDM4EKMT2AMEN1
SCHEMBL18220156 0.83 ALDH1A1 (0.56) APPALDH1A1KDM4EKMT2AGAA
SCHEMBL25609494 0.82 APP (0.39) APPALDH1A1GAAMAPTSYK

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-3119761-B1 AMYLOID TARGETING AGENTS AND METHODS OF USING THE SAME AMYDIS DIAGNOSTICS INC (US) 2023-06-07 EP disclosed