SCHEMBL12419847

SCHEMBL12419847

CN(Cc1ccccc1)Cc1cc(OCc2ccccc2)ccc1B(O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.52
MAOB P27338 7/20 0.52
BCHE P06276 4/20 0.52
MAOA P21397 3/20 0.52
CYP3A4 P08684 2/20 0.52
CCR5 P51681 1/20 0.47
LIPE Q05469 1/20 0.47
KCNH2 Q12809 1/20 0.46
MCHR1 Q99705 1/20 0.46
ALOX5 P09917 2/20 0.46
HRH3 Q9Y5N1 2/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 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
SCHEMBL12419800 0.83 LIPE (0.51) ACHEMAOBBCHEMAOACYP3A4
SCHEMBL15935622 0.83 LIPE (0.51) MAOBLIPEALOX5HRH3PTGS1
SCHEMBL12419858 0.78 BCHE (0.59) MAOBBCHE
SCHEMBL4695639 0.78 ALDH1A1 (0.55) ACHEMAOBBCHEMAOACYP3A4
SCHEMBL29956436 0.78 ALDH1A1 (0.55) ACHEMAOBBCHEMAOACYP3A4
SCHEMBL5433420 0.77 LIPE (0.68) MAOBMAOALIPEALOX5HRH3
SCHEMBL539890 0.77 LIPE (0.54) MAOBMAOALIPEALOX5HRH3
SCHEMBL29953350 0.77 LIPE (0.68) MAOBMAOALIPEALOX5HRH3
SCHEMBL29950569 0.77 LIPE (0.54) MAOBMAOALIPEALOX5HRH3
SCHEMBL29954101 0.76 LIPE (0.53) MAOBLIPEALOX5HRH3PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150368278-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. (US) 2015-12-24 US disclosed
US-20150368278-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. (US) 2015-12-24 US disclosed
US-8957049-B2 Inhibitors of fatty acid amide hydrolase INFINITY PHARMACEUTICALS, INC. (US) 2015-02-17 US disclosed
US-8957049-B2 Inhibitors of fatty acid amide hydrolase INFINITY PHARMACEUTICALS, INC. (US) 2015-02-17 US disclosed
US-20110172186-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. 2011-07-14 US disclosed
US-20110172186-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. 2011-07-14 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 (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-20110172186-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 ACHE 445/4885MAOB 91/4885BCHE 160/4885
US-20150368278-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 ACHE 445/4885MAOB 91/4885BCHE 160/4885

“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.