SCHEMBL8289157

SCHEMBL8289157

CC(=O)C1CC=C(/C=C2/SC(=S)N(c3ccccc3)C2=O)O1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DUSP22 Q9NRW4 11/20 0.52
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
ALDH1A1 P00352 2/20 0.51
MAPT P10636 3/20 0.50
RECQL P46063 1/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
THRB P10828 1/20 0.50
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
DUSP3 P51452 2/20 0.49
CFTR P13569 1/20 0.46
MCL1 Q07820 2/20 0.44
PLA2G1B P04054 1/20 0.44
BLM P54132 1/20 0.44
ATG4B Q9Y4P1 1/20 0.44
AMY1A P0DUB6 1/20 0.44

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
SCHEMBL13766490 0.76 MAPT (0.55) DUSP22MEN1KMT2AALDH1A1MAPT
SCHEMBL9917038 0.73 DUSP22 (0.77) DUSP22MEN1KMT2AALDH1A1MAPT
SCHEMBL10035996 0.73 DUSP22 (0.77) DUSP22MEN1KMT2AALDH1A1MAPT
SCHEMBL12123516 0.73 DUSP22 (0.77) DUSP22MEN1KMT2AALDH1A1MAPT
SCHEMBL3892527 0.71 MEN1 (0.60) DUSP22MEN1KMT2AALDH1A1MAPT
SCHEMBL3892524 0.71 MEN1 (0.60) DUSP22MEN1KMT2AALDH1A1MAPT
SCHEMBL10035969 0.70 MEN1 (0.73) DUSP22MEN1KMT2AALDH1A1MAPT
SCHEMBL11116026 0.70 MAPT (0.60) DUSP22MEN1KMT2AALDH1A1MAPT
SCHEMBL8337257 0.69 KMT2A (0.49) DUSP22MEN1KMT2AALDH1A1MAPT
SCHEMBL20005694 0.69 MEN1 (0.62) DUSP22MEN1KMT2AALDH1A1MAPT

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-2005041951-A2 RHODANINE DERIVATIVES FOR USE AS ANTIVIRAL AGENTS RIGEL PHARMACEUTICALS, INC. (US) 2005-05-12 WO disclosed