SCHEMBL8290190

SCHEMBL8290190

O=C1/C(=C\c2ccco2)SC(=S)N1c1cccc(I)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 13/20 0.74
▸ POLB P06746 13/20 0.74
▸ KMT2A Q03164 13/20 0.74
▸ MAPT P10636 12/20 0.74
▸ L3MBTL1 Q9Y468 9/20 0.74
▸ ALDH1A1 P00352 8/20 0.74
▸ KDM4E B2RXH2 7/20 0.74
▸ MAPK1 P28482 4/20 0.74
▸ THRB P10828 1/20 0.74
▸ TDP1 Q9NUW8 6/20 0.66
▸ ALOX12 P18054 3/20 0.66
▸ RAB9A P51151 2/20 0.66
▸ LMNA P02545 2/20 0.66
▸ HPGD P15428 1/20 0.66
▸ RECQL P46063 6/20 0.65
▸ BLM P54132 4/20 0.65
▸ MCL1 Q07820 3/20 0.65
▸ APEX1 P27695 4/20 0.57
▸ PKM P14618 2/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL3892739 0.87 MEN1 (0.76) MEN1POLBKMT2AMAPTL3MBTL1
SCHEMBL3892743 0.87 MEN1 (0.76) MEN1POLBKMT2AMAPTL3MBTL1
SCHEMBL3904333 0.86 MEN1 (0.74) MEN1POLBKMT2AMAPTL3MBTL1
SCHEMBL3904330 0.86 MEN1 (0.74) MEN1POLBKMT2AMAPTL3MBTL1
SCHEMBL6278205 0.86 MEN1 (0.74) MEN1POLBKMT2AMAPTL3MBTL1
SCHEMBL3894740 0.86 MEN1 (0.74) MEN1POLBKMT2AMAPTL3MBTL1
SCHEMBL3894736 0.86 MEN1 (0.74) MEN1POLBKMT2AMAPTL3MBTL1
SCHEMBL3012532 0.85 MEN1 (1.00) MEN1POLBKMT2AMAPTL3MBTL1
SCHEMBL3892542 0.84 MEN1 (0.71) MEN1POLBKMT2AMAPTL3MBTL1
SCHEMBL3892547 0.84 MEN1 (0.71) MEN1POLBKMT2AMAPTL3MBTL1

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
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