SCHEMBL3894736

SCHEMBL3894736

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

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 11/20 0.74
▸ POLB P06746 11/20 0.74
▸ KMT2A Q03164 11/20 0.74
▸ MAPT P10636 10/20 0.74
▸ ALDH1A1 P00352 7/20 0.74
▸ L3MBTL1 Q9Y468 7/20 0.74
▸ KDM4E B2RXH2 6/20 0.74
▸ MAPK1 P28482 2/20 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 5/20 0.65
▸ BLM P54132 4/20 0.65
▸ MCL1 Q07820 3/20 0.65
▸ APEX1 P27695 3/20 0.57
▸ PKM P14618 2/20 0.57
▸ MAP3K5 Q99683 1/20 0.55

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
SCHEMBL3894740 1.00 MEN1 (0.74) MEN1POLBKMT2AMAPTALDH1A1
SCHEMBL6278205 1.00 MEN1 (0.74) MEN1POLBKMT2AMAPTALDH1A1
SCHEMBL3892743 0.87 MEN1 (0.76) MEN1POLBKMT2AMAPTALDH1A1
SCHEMBL3892739 0.87 MEN1 (0.76) MEN1POLBKMT2AMAPTALDH1A1
SCHEMBL3904330 0.86 MEN1 (0.74) MEN1POLBKMT2AMAPTALDH1A1
SCHEMBL8290190 0.86 MEN1 (0.74) MEN1POLBKMT2AMAPTALDH1A1
SCHEMBL3904333 0.86 MEN1 (0.74) MEN1POLBKMT2AMAPTALDH1A1
SCHEMBL3012532 0.85 MEN1 (1.00) MEN1POLBKMT2AMAPTALDH1A1
SCHEMBL3892542 0.84 MEN1 (0.71) MEN1POLBKMT2AMAPTALDH1A1
SCHEMBL3892547 0.84 MEN1 (0.71) MEN1POLBKMT2AMAPTALDH1A1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137644-A1 RHODANINE COMPOSITIONS FOR USE AS ANTIVIRAL AGENTS RIGEL PHARMACEUTICALS, INC. (US) 2009-05-28 — — US claimed
WO-2005041951-A2 RHODANINE DERIVATIVES FOR USE AS ANTIVIRAL AGENTS RIGEL PHARMACEUTICALS, INC. (US) 2005-05-12 — — WO claimed
US-20130287727-A1 Psyllid Attractants and Their Uses INSCENT, INC. (US) 2013-10-31 — — US disclosed
US-20130287727-A1 Psyllid Attractants and Their Uses INSCENT, INC. (US) 2013-10-31 — — US disclosed
US-7566732-B2 Rhodanine compositions for use as antiviral agents RIGEL PHARMACEUTICALS, INC. (US) 2009-07-28 — — US disclosed
US-7566732-B2 Rhodanine compositions for use as antiviral agents RIGEL PHARMACEUTICALS, INC. (US) 2009-07-28 — — US disclosed
US-7566732-B2 Rhodanine compositions for use as antiviral agents RIGEL PHARMACEUTICALS, INC. (US) 2009-07-28 — — US disclosed
US-20090137644-A1 RHODANINE COMPOSITIONS FOR USE AS ANTIVIRAL AGENTS RIGEL PHARMACEUTICALS, INC. (US) 2009-05-28 — — US disclosed
US-20090137644-A1 RHODANINE COMPOSITIONS FOR USE AS ANTIVIRAL AGENTS RIGEL PHARMACEUTICALS, INC. (US) 2009-05-28 — — US disclosed
US-20090137644-A1 RHODANINE COMPOSITIONS FOR USE AS ANTIVIRAL AGENTS RIGEL PHARMACEUTICALS, INC. (US) 2009-05-28 — — US disclosed
US-20060276520-A1 Rhodanine derivatives and pharmaceutical compositions containing them RIGEL PHARMACEUTICALS, INC. (US) 2006-12-07 — — US disclosed
WO-2005041951-A2 RHODANINE DERIVATIVES FOR USE AS ANTIVIRAL AGENTS RIGEL PHARMACEUTICALS, INC. (US) 2005-05-12 — — WO disclosed
WO-2004043955-A1 RHODANINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RIGEL PHARMACEUTICALS, INC. (US) 2004-05-27 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130287727-A1 Psyllid Attractants and Their Uses L3MBTL3, LPAR3, LPXN MEN1 4287/4885POLB 3313/4885KMT2A 1612/4885
US-20060276520-A1 Rhodanine derivatives and pharmaceutical compositions containing them UBQLN1, UBQLN2, UBE2G2 MEN1 1562/4885POLB 2008/4885KMT2A 901/4885
US-20090137644-A1 RHODANINE COMPOSITIONS FOR USE AS ANTIVIRAL AGENTS RBX1, ITCH, UBQLN1 MEN1 2869/4885POLB 433/4885KMT2A 1020/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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