SCHEMBL5234075

SCHEMBL5234075

CN(C(=O)c1c(O)c2c(-c3ccccc3)csc2n(C)c1=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
PGR P06401 1/20 0.55
SRC P12931 1/20 0.42
HDAC4 P56524 1/20 0.42
BRD4 O60885 2/20 0.38
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
TGM2 P21980 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
TP53 P04637 1/20 0.35
MAPT P10636 2/20 0.34
TSHR P16473 1/20 0.34
GNRHR P30968 1/20 0.34
GAA P10253 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.33
GABRA1 P14867 1/20 0.33

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
SCHEMBL4494430 0.93 MEN1 (0.50) MEN1KMT2APGRSRCHDAC4
SCHEMBL4509473 0.86 KMT2A (0.57) MEN1KMT2APGRSRCHDAC4
SCHEMBL4507747 0.85 KMT2A (0.56) MEN1KMT2APGRSRCHDAC4
SCHEMBL5236265 0.85 KMT2A (0.56) MEN1KMT2APGRSRCHDAC4
SCHEMBL4496687 0.85 KMT2A (0.56) MEN1KMT2APGRSRCHDAC4
SCHEMBL4510344 0.85 KMT2A (0.56) MEN1KMT2APGRSRCHDAC4
SCHEMBL4506552 0.85 KMT2A (0.56) MEN1KMT2APGRSRCHDAC4
SCHEMBL4517618 0.84 KMT2A (0.55) MEN1KMT2APGRSRCHDAC4
SCHEMBL4506852 0.83 KMT2A (0.57) MEN1KMT2APGRSRCHDAC4
SCHEMBL4517818 0.83 KMT2A (0.54) MEN1KMT2APGRSRCHDAC4

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-1776369-B1 THIENOPYRIDONE CARBOXAMIDES AND THEIR MEDICAL USE ACTIVE BIOTECH AB (SE) 2007-10-10 EP disclosed