SCHEMBL25609779

SCHEMBL25609779

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.38
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
NSD2 O96028 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
CASP1 P29466 1/20 0.37
HTT P42858 1/20 0.37
CASP7 P55210 1/20 0.37
CASP6 P55212 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ERN1 O75460 1/20 0.36
SYK P43405 3/20 0.34
ALDH1A1 P00352 4/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
CHEK1 O14757 1/20 0.33
PGR P06401 1/20 0.32

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
SCHEMBL18220182 0.91 APP (0.43) APPMAPTKDM4ENSD2LMNA
SCHEMBL18221450 0.89 SYK (0.37) APPMAPTKDM4ENSD2LMNA
SCHEMBL18220287 0.87 LMNA (0.35) APPMAPTKDM4ENSD2LMNA
SCHEMBL23134878 0.87 APP (0.34) APPPGR
SCHEMBL17120884 0.85 KDM4E (0.33) APPMAPTKDM4ENSD2LMNA
SCHEMBL18220296 0.84 KDM4E (0.33) APPMAPTKDM4ENSD2LMNA
SCHEMBL20306979 0.84 KDM4E (0.33) APPMAPTKDM4ENSD2LMNA
SCHEMBL18220166 0.83 APP (0.42) APPMAPTKDM4ETSHRCASP1
SCHEMBL18220176 0.82 APP (0.43) APPMAPTERN1ALDH1A1CTSL
SCHEMBL25610291 0.82 APP (0.38) APPMAPTKDM4ENSD2LMNA

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