SCHEMBL3892576

SCHEMBL3892576

O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)SC1=S

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1AN Q9NWT6 1/20 0.81
MAPT P10636 1/20 0.78
MEN1 O00255 1/20 0.75
PKM P14618 1/20 0.75
KMT2A Q03164 1/20 0.75
MCL1 Q07820 1/20 0.75
TDP1 Q9NUW8 1/20 0.75
MAP3K5 Q99683 4/20 0.71
PTPN22 Q9Y2R2 2/20 0.71
APEX1 P27695 1/20 0.69
STAT3 P40763 1/20 0.65

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
SCHEMBL13056328 1.00 HIF1AN (0.81) HIF1ANMAPTMEN1PKMKMT2A
SCHEMBL3892582 1.00 HIF1AN (0.81) HIF1ANMAPTMEN1PKMKMT2A
SCHEMBL7641513 0.91 MAPT (0.83) HIF1ANMAPTMEN1PKMKMT2A
SCHEMBL6797191 0.91 MAPT (0.83) HIF1ANMAPTMEN1PKMKMT2A
SCHEMBL3893475 0.90 PTPN22 (0.72) HIF1ANMAPTMEN1PKMKMT2A
SCHEMBL3893480 0.90 PTPN22 (0.72) HIF1ANMAPTMEN1PKMKMT2A
SCHEMBL16492645 0.90 PTPN22 (0.75) HIF1ANMAPTMEN1PKMKMT2A
SCHEMBL13056366 0.90 MAPT (0.79) HIF1ANMAPTMEN1KMT2ATDP1
Claficapavir SCHEMBL6789043 0.90 HIF1AN (1.00) HIF1ANMAPTMEN1PKMKMT2A
Claficapavir SCHEMBL13326245 0.90 HIF1AN (1.00) HIF1ANMAPTMEN1PKMKMT2A

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 12 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-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
US-20020052396-A1 Compounds, compositions and methods for treating or preventing viral infections and associated diseases BAILEY THOMAS R (US) 2002-05-02 US 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-20060276520-A1 Rhodanine derivatives and pharmaceutical compositions containing them UBQLN1, UBQLN2, UBE2G2 HIF1AN 647/4885MAPT 1187/4885MEN1 1562/4885
US-20020052396-A1 Compounds, compositions and methods for treating or preventing viral infections and associated diseases RXRG, TREH, RARG HIF1AN 285/4885MAPT 1526/4885MEN1 3202/4885
US-20090137644-A1 RHODANINE COMPOSITIONS FOR USE AS ANTIVIRAL AGENTS RBX1, ITCH, UBQLN1 HIF1AN 714/4885MAPT 880/4885MEN1 2869/4885

“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.