SCHEMBL2595128

SCHEMBL2595128

CN1C(=O)CS/C1=N/c1ccc(C(=O)O)cc1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.71
▸ KMT2A Q03164 3/20 0.71
▸ ALDH1A1 P00352 8/20 0.61
▸ LMNA P02545 2/20 0.52
▸ TP53 P04637 1/20 0.51
▸ GAA P10253 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ GFER P55789 1/20 0.47
▸ MAPT P10636 4/20 0.46
▸ POLB P06746 2/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ PKM P14618 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ THRB P10828 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RECQL P46063 1/20 0.42

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
SCHEMBL14876942 1.00 MEN1 (0.71) MEN1KMT2AALDH1A1LMNATP53
SCHEMBL2595132 1.00 MEN1 (0.71) MEN1KMT2AALDH1A1LMNATP53
SCHEMBL4056197 0.88 MEN1 (0.60) MEN1KMT2AALDH1A1LMNATP53
SCHEMBL4056200 0.88 MEN1 (0.60) MEN1KMT2AALDH1A1LMNATP53
SCHEMBL2589796 0.83 MEN1 (0.68) MEN1KMT2AALDH1A1LMNAGAA
SCHEMBL2589792 0.83 MEN1 (0.68) MEN1KMT2AALDH1A1LMNAGAA
Bromide SCHEMBL11180829 0.81 MEN1 (0.66) MEN1KMT2AALDH1A1LMNAGAA
SCHEMBL2587984 0.81 MEN1 (0.55) MEN1KMT2AALDH1A1LMNAGAA
SCHEMBL2587982 0.81 MEN1 (0.55) MEN1KMT2AALDH1A1LMNAGAA
Bromide SCHEMBL11277318 0.81 MEN1 (0.66) MEN1KMT2AALDH1A1LMNAGAA

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
WO-2011135303-A2 UBIQUITINATION MODULATORS ITI SCOTLAND LIMITED (GB) 2011-11-03 — — WO disclosed
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