SCHEMBL6651682

SCHEMBL6651682

[O]c1ccccc1C=C1SC(=O)NC1=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.69
IGF1R P08069 2/20 0.69
NAT1 P18440 1/20 0.69
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
AKR1B1 P15121 3/20 0.65
PIM1 P11309 6/20 0.64
PIM2 Q9P1W9 6/20 0.64
PIM3 Q86V86 2/20 0.64
GSK3B P49841 2/20 0.63
TDP2 O95551 1/20 0.61
CASP7 P55210 1/20 0.61
CASP9 P55211 1/20 0.61
CASP6 P55212 1/20 0.61
CASP8 Q14790 1/20 0.61
ALDH1A1 P00352 2/20 0.56
PLA2G1B P04054 2/20 0.56
POLB P06746 2/20 0.56
HTT P42858 2/20 0.56
ATG4B Q9Y4P1 2/20 0.56

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
SCHEMBL6651680 1.00 TTR (0.69) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL14564270 0.81 NAT1 (1.00) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL1250147 0.81 TTR (0.67) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL3939871 0.81 TTR (0.67) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL7464188 0.81 TTR (1.00) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL7456375 0.81 IGF1R (1.00) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL1249158 0.81 NAT1 (1.00) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL13724876 0.81 TTR (1.00) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL3939868 0.81 TTR (0.67) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL1249157 0.81 NAT1 (1.00) TTRIGF1RNAT1MEN1KMT2A

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
EP-1189583-A4 INDOLE DERIVATIVES NEURIM PHARMA 1991 (IL) 2004-04-14 EP claimed
EP-1189583-A1 INDOLE DERIVATIVES NEURIM PHARMACEUTICALS (1991) LIMITED (IL) 2002-03-27 EP claimed
WO-2000072815-A1 INDOLE DERIVATIVES NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2000-12-07 WO claimed