SCHEMBL1730157

SCHEMBL1730157

O=C(NCc1ccccc1)OCC(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
LMNA P02545 2/20 0.50
PLAU P00749 1/20 0.49
PPID Q08752 1/20 0.48
TXNRD1 Q16881 1/20 0.47
MAPT P10636 1/20 0.47
TSHR P16473 1/20 0.46
GAA P10253 1/20 0.46
MAPK14 Q16539 1/20 0.46

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
SCHEMBL3282735 0.91 ALDH1A1 (0.51) ALDH1A1LMNAPLAUMAPK14
SCHEMBL12281982 0.89 MLYCD (0.46) ALDH1A1LMNATSHRGAAMAPK14
SCHEMBL3276617 0.88 MAPK14 (0.62) ALDH1A1LMNAGAAMAPK14
SCHEMBL11563398 0.83 PLAU (0.49) ALDH1A1PLAUPPIDMAPTTSHR
SCHEMBL12994525 0.83 LMNA (0.45) ALDH1A1LMNAPLAUPPIDMAPT
SCHEMBL16937317 0.82 PLAU (0.46) ALDH1A1LMNAPLAUPPIDTXNRD1
SCHEMBL1730789 0.81 HDAC3 (0.52) ALDH1A1GAA
SCHEMBL29924988 0.79 ALDH1A1 (0.49) ALDH1A1PPIDMAPTTSHRGAA
Benzyl Benzylcarbamate SCHEMBL1136818 0.79 PLAU (0.70) ALDH1A1LMNAPLAU
SCHEMBL19716546 0.79 PLAU (0.54) ALDH1A1PLAUPPIDMAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1673337-B1 Arylalkylcarbamate derivatives, preparation method thereof and use of same in therapeutics SANOFI SA (FR) 2011-11-23 EP claimed
US-7696374-B2 Arylalklcarbamate derivatives, preparation method thereof and use of same in therapeutics SANOFI-AVENTIS (FR) 2010-04-13 US claimed
US-20060223805-A1 Arylalklcarbamate derivatives, preparation method thereof and use of same in therapeutics SANOFI-AVENTIS (FR) 2006-10-05 US claimed
CN-102348698-B Inhibitors of beta-secretase VITAE PHARMACEUTICALS INC 2015-06-03 CN disclosed
US-7696374-B2 Arylalklcarbamate derivatives, preparation method thereof and use of same in therapeutics SANOFI-AVENTIS (FR) 2010-04-13 US disclosed
EP-1972616-A1 Derivatives of arylalkylcarbamates, process for their preparation and therapeutic application thereof Sanofi-Aventis (FR) 2008-09-24 EP disclosed
US-20060223805-A1 Arylalklcarbamate derivatives, preparation method thereof and use of same in therapeutics SANOFI-AVENTIS (FR) 2006-10-05 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-20060223805-A1 Arylalklcarbamate derivatives, preparation method thereof and use of same in therapeutics GBA1, NAT1, AADAC ALDH1A1 32/4885LMNA 1935/4885PLAU 2655/4885

“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.