SCHEMBL7984450

SCHEMBL7984450

CNC(=O)c1ccc(OC)c(F)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.67
HTT P42858 2/20 0.67
MAPK1 P28482 1/20 0.67
RAB9A P51151 1/20 0.67
TAS1R3 Q7RTX0 1/20 0.61
TAS1R1 Q7RTX1 1/20 0.61
KCNQ3 O43525 1/20 0.56
KCNQ2 O43526 1/20 0.56
PLK1 P53350 1/20 0.53
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
PDE4D Q08499 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
PTK2 Q05397 1/20 0.49
ALDH1A1 P00352 3/20 0.49
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
SLC6A3 Q01959 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
SCHEMBL27030863 0.86 PLK1 (0.53) LMNAHTTMAPK1RAB9ATAS1R3
SCHEMBL6582492 0.85 HTT (0.65) LMNAHTTMAPK1RAB9ATAS1R3
SCHEMBL30622701 0.85 HTT (0.65) LMNAHTTMAPK1RAB9ATAS1R3
SCHEMBL4151619 0.84 CYP1A2 (0.66) MAPK1PLK1MEN1KMT2APDE4D
Hydrochloric Acid SCHEMBL6510141 0.83 HTT (0.63) LMNAHTTMAPK1RAB9ATAS1R3
SCHEMBL1988161 0.82 HTT (0.71) LMNAHTTMAPK1RAB9ATAS1R3
SCHEMBL30147439 0.82 EPHX2 (0.55) LMNAHTTMAPK1RAB9ATAS1R3
SCHEMBL13701797 0.82 RAB9A (0.61) LMNAHTTMAPK1RAB9ATAS1R3
SCHEMBL30147633 0.82 KCNQ3 (0.47) LMNAHTTMAPK1RAB9ATAS1R3
SCHEMBL28217099 0.82 HTT (0.76) LMNAHTTMAPK1RAB9ATAS1R3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
EP-1532122-B1 11-beta-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK SHARP & DOHME (US) 2011-12-14 EP disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 WO disclosed
US-7179802-B2 11-beta-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK & CO., INC. (US) 2007-02-20 US disclosed
US-7179802-B2 11-beta-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK & CO., INC. (US) 2007-02-20 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 (1 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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 LMNA 4210/4885HTT 370/4885MAPK1 467/4885

“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.