SCHEMBL3580424

SCHEMBL3580424

Cc1ccccc1NC(=O)c1sc(NC(=O)/C=C/c2ccccc2)nc1C

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.80
KMT2A Q03164 2/20 0.80
MAPT P10636 2/20 0.80
HSP90AA1 P07900 1/20 0.80
HPGD P15428 6/20 0.78
ALDH1A1 P00352 5/20 0.78
NPSR1 Q6W5P4 4/20 0.78
KDM4E B2RXH2 4/20 0.70
LMNA P02545 2/20 0.70
RAB9A P51151 3/20 0.67
RXFP1 Q9HBX9 1/20 0.65
MMP1 P03956 3/20 0.63
MMP2 P08253 3/20 0.63
MMP9 P14780 3/20 0.63
EGFR P00533 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.56
FSCN1 Q16658 1/20 0.53
ALOX5 P09917 2/20 0.52
PKM P14618 1/20 0.52
CHRNA7 P36544 1/20 0.52

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
SCHEMBL3580427 1.00 MEN1 (0.80) MEN1KMT2AMAPTHSP90AA1HPGD
SCHEMBL3592122 0.87 ALDH1A1 (1.00) MEN1KMT2AMAPTHSP90AA1HPGD
SCHEMBL3592126 0.87 ALDH1A1 (1.00) MEN1KMT2AMAPTHSP90AA1HPGD
SCHEMBL3577530 0.85 HPGD (0.78) MEN1KMT2AMAPTHSP90AA1HPGD
SCHEMBL3577535 0.85 HPGD (0.78) MEN1KMT2AMAPTHSP90AA1HPGD
SCHEMBL5607983 0.84 CHRNA7 (0.60) MEN1KMT2AMAPTHSP90AA1ALDH1A1
SCHEMBL3589298 0.81 NPSR1 (0.73) MEN1KMT2AMAPTHSP90AA1HPGD
SCHEMBL3589303 0.81 NPSR1 (0.73) MEN1KMT2AMAPTHSP90AA1HPGD
SCHEMBL3590371 0.81 LCK (0.70) MEN1KMT2AMAPTHSP90AA1HPGD
SCHEMBL3587381 0.81 ALDH1A1 (0.82) MEN1KMT2AMAPTHSP90AA1HPGD

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-8541457-B2 Aminothiazole derivatives as human stearoyl-CoA desaturase inhibitors XENON PHARMACEUTICALS INC. (CA) 2013-09-24 US claimed
US-20130096056-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2013-04-18 US claimed
EP-2540296-A1 Arminothiazole derivatives as human stearoyl-coa desaturase inhibitors Xenon Pharmaceuticals Inc. (CA) 2013-01-02 EP claimed
US-20100152187-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2010-06-17 US claimed
EP-2029138-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2009-03-04 EP claimed
WO-2007130075-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2007-11-15 WO claimed
US-8541457-B2 Aminothiazole derivatives as human stearoyl-CoA desaturase inhibitors XENON PHARMACEUTICALS INC. (CA) 2013-09-24 US disclosed
US-20130096056-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2013-04-18 US disclosed
EP-2540296-A1 Arminothiazole derivatives as human stearoyl-coa desaturase inhibitors Xenon Pharmaceuticals Inc. (CA) 2013-01-02 EP disclosed
US-20100152187-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2010-06-17 US disclosed
EP-2029138-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2009-03-04 EP disclosed
WO-2007130075-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2007-11-15 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 (2 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-20100152187-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS SCD, SCD5, ACAT1 MEN1 4846/4885KMT2A 1897/4885MAPT 1788/4885
US-20130096056-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS SCD, SCD5, ACAT1 MEN1 4846/4885KMT2A 1901/4885MAPT 1782/4885

“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.