SCHEMBL8042435

SCHEMBL8042435

O=CN(SCl)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.34
NPSR1 Q6W5P4 2/20 0.34
ALOX15 P16050 1/20 0.34
HTT P42858 3/20 0.34
ATM Q13315 2/20 0.34
HPGD P15428 2/20 0.34
HSP90AA1 P07900 1/20 0.34
XBP1 P17861 1/20 0.34
ALOX12 P18054 1/20 0.34
RUNX1 Q01196 1/20 0.34
CBFB Q13951 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
CYP2A6 P11509 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL10825668 0.81 ALDH1A1 (0.37) ALDH1A1NPSR1ALOX15HTTATM
SCHEMBL27903688 0.77 NPSR1 (0.39) ALDH1A1NPSR1ALOX15HTTATM
SCHEMBL544384 0.76 MAPT (0.35) ALDH1A1NPSR1ALOX15HTTATM
SCHEMBL3155192 0.69 ALDH1A1 (0.39) ALDH1A1NPSR1ALOX15HTTATM
SCHEMBL27937066 0.67 ALDH1A1 (0.36) ALDH1A1NPSR1ALOX15HTTATM
SCHEMBL7978097 0.67 ALDH1A1 (0.42) ALDH1A1NPSR1ALOX15HTTATM
SCHEMBL5516786 0.67 ALDH1A1 (0.42) ALDH1A1NPSR1ALOX15HTTATM
SCHEMBL43388 0.67 ALDH1A1 (0.42) ALDH1A1NPSR1ALOX15HTTATM
SCHEMBL8846720 0.67 ALDH1A1 (0.37) ALDH1A1NPSR1ALOX15HTTATM
SCHEMBL28038079 0.65 ALDH1A1 (0.40) ALDH1A1NPSR1ALOX15HTTATM

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4017468-A IMIDE-MODIFIED TERPOLYMERSSULFUR-CURED RUBBER, TIRES THE GOODYEAR TIRE & RUBBER COMPANY (US) 1977-04-12 US claimed
EP-0989171-A1 N-halothio-amide-modified elastomers and their application as adhesives for precured elastomeric substrates THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-03-29 EP disclosed
US-4017468-A IMIDE-MODIFIED TERPOLYMERSSULFUR-CURED RUBBER, TIRES THE GOODYEAR TIRE & RUBBER COMPANY (US) 1977-04-12 US disclosed