SCHEMBL3587469

SCHEMBL3587469

Cc1nc(NC(=O)c2cccc(F)c2)sc1C(=O)N1CCOCC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
ALDH1A1 P00352 4/20 0.63
MAPT P10636 3/20 0.63
KDM4E B2RXH2 2/20 0.63
HSP90AA1 P07900 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
RAB9A P51151 6/20 0.55
NPC1 O15118 5/20 0.55
TP53 P04637 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.52
MTOR P42345 1/20 0.52
TRPM8 Q7Z2W7 1/20 0.52
GAA P10253 3/20 0.51
ALOX15 P16050 1/20 0.51
TSHR P16473 1/20 0.51
CNR1 P21554 1/20 0.51
HPGDS O60760 3/20 0.49
HTR2C P28335 1/20 0.49
SCD O00767 1/20 0.48

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
SCHEMBL3588548 0.81 KMT2A (0.54) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3581996 0.81 KDM4E (0.67) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3585055 0.81 SCD (0.66) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3587329 0.79 KMT2A (0.81) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3583034 0.78 KMT2A (0.62) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3583698 0.78 KMT2A (1.00) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3578788 0.78 CNR1 (0.55) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3574876 0.77 KDM4E (0.65) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3589503 0.77 KMT2A (0.67) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL3581604 0.76 ALDH1A1 (0.77) MEN1KMT2AALDH1A1MAPTKDM4E

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 10 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
CN-101208089-A Aminothiazole derivatives as human stearoyl-CoA desaturase inhibitors XENON PHARMACEUTICALS INC (CA) 2008-06-25 CN 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
CN-101208089-A Aminothiazole derivatives as human stearoyl-CoA desaturase inhibitors XENON PHARMACEUTICALS INC (CA) 2008-06-25 CN 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 1897/4885ALDH1A1 927/4885
US-20130096056-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS SCD, SCD5, ACAT1 MEN1 4846/4885KMT2A 1901/4885ALDH1A1 910/4885

“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.