SCHEMBL3591255

SCHEMBL3591255

Cc1ccccc1NC(=O)c1sc(NC(=O)COc2ccccc2)nc1C

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.78
SMN1; SMN2 Q16637 4/20 0.78
MEN1 O00255 4/20 0.78
KMT2A Q03164 4/20 0.78
MAPT P10636 7/20 0.72
KDM4E B2RXH2 2/20 0.72
RAB9A P51151 6/20 0.72
RXFP1 Q9HBX9 2/20 0.72
NPC1 O15118 3/20 0.71
TSHR P16473 2/20 0.71
LMNA P02545 2/20 0.60
GAA P10253 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
POLB P06746 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
THRB P10828 1/20 0.56
TP53 P04637 1/20 0.55
MAPK1 P28482 1/20 0.53

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
SCHEMBL3584529 0.88 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL3579484 0.85 MAPT (0.84) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL3597783 0.84 KMT2A (0.61) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL5607983 0.84 CHRNA7 (0.60) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL3584748 0.83 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL3590371 0.80 LCK (0.70) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL3587099 0.78 SMN1; SMN2 (0.73) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL3582480 0.77 MAPT (0.69) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL771923 0.76 LCK (0.77) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL3586204 0.76 RAB9A (0.80) ALDH1A1MEN1KMT2AMAPTKDM4E

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 ALDH1A1 927/4885SMN1; SMN2 1323/4885MEN1 4846/4885
US-20130096056-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS SCD, SCD5, ACAT1 ALDH1A1 910/4885SMN1; SMN2 1277/4885MEN1 4846/4885

“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.