SCHEMBL25610090

SCHEMBL25610090

COCCCNS(=O)(=O)/C(C#N)=C/c1ccc(-c2ccc3cc(N4CCOCC4)ccc3c2)n1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.46
SYK P43405 2/20 0.38
ALDH1A1 P00352 8/20 0.37
KDM4E B2RXH2 5/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
GAA P10253 3/20 0.37
HPGD P15428 3/20 0.37
MAPT P10636 2/20 0.37
HTT P42858 2/20 0.37
USP2 O75604 2/20 0.37
THRB P10828 1/20 0.36
CASP1 P29466 3/20 0.35
TSHR P16473 2/20 0.35
LMNA P02545 2/20 0.35
CASP7 P55210 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NSD2 O96028 1/20 0.35
CASP6 P55212 1/20 0.35
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL18220191 0.95 APP (0.47) APPSYKALDH1A1KDM4EKMT2A
SCHEMBL18220187 0.87 APP (0.47) APPALDH1A1KMT2AMEN1MAPT
SCHEMBL18220178 0.87 APP (0.46) APPALDH1A1KDM4EKMT2AMEN1
SCHEMBL25610126 0.87 POLB (0.39) SYKALDH1A1KDM4EKMT2AGAA
SCHEMBL25610089 0.86 APP (0.50) APPALDH1A1KDM4EKMT2AMEN1
SCHEMBL25605989 0.84 APP (0.61) APPSYKALDH1A1KDM4EKMT2A
SCHEMBL25609474 0.84 APP (0.47) APPSYKALDH1A1KDM4EKMT2A
SCHEMBL18221500 0.84 SYK (0.39) APPSYKALDH1A1KDM4EKMT2A
SCHEMBL18220221 0.84 APP (0.37) APPSYKALDH1A1KDM4EKMT2A
SCHEMBL18220192 0.83 KMT2A (0.55) APPALDH1A1KDM4EKMT2AMEN1

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