SCHEMBL1129178

SCHEMBL1129178

Brc1ccc2nc(COc3ccccc3)ccc2c1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 8/20 0.67
CYSLTR2 Q9NS75 4/20 0.67
KCNH2 Q12809 1/20 0.53
GPBAR1 Q8TDU6 7/20 0.52
PDE10A Q9Y233 3/20 0.50
CYP1A2 P05177 1/20 0.47
FFAR1 O14842 1/20 0.47
AKR1B1 P15121 1/20 0.47

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
SCHEMBL10512001 0.84 PDE10A (0.68) CYSLTR1CYSLTR2GPBAR1PDE10ACYP1A2
SCHEMBL1557987 0.81 CYSLTR1 (0.76) CYSLTR1CYSLTR2GPBAR1PDE10AFFAR1
SCHEMBL10690028 0.81 CYSLTR1 (0.69) CYSLTR1CYSLTR2GPBAR1PDE10ACYP1A2
SCHEMBL10547998 0.80 CYSLTR1 (1.00) CYSLTR1CYSLTR2KCNH2GPBAR1PDE10A
SCHEMBL12419252 0.78 CYSLTR1 (0.61) CYSLTR1CYSLTR2KCNH2GPBAR1PDE10A
SCHEMBL16621472 0.78 BACE1 (0.49) CYSLTR1CYSLTR2GPBAR1PDE10ACYP1A2
SCHEMBL30718562 0.78 BACE1 (0.49) CYSLTR1CYSLTR2GPBAR1PDE10ACYP1A2
SCHEMBL13136434 0.76 BACE1 (0.47)
SCHEMBL10543657 0.75 CYSLTR1 (0.87) CYSLTR1CYSLTR2GPBAR1PDE10AFFAR1
SCHEMBL13136433 0.75 KCNH2 (0.50) KCNH2

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 5 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-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
EP-2282742-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE Infinity Pharmaceuticals, Inc. (US) 2011-02-16 EP disclosed
WO-2009126691-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC (US) 2009-10-15 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-20110172186-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 CYSLTR1 349/4885CYSLTR2 259/4885KCNH2 2716/4885
US-20150368278-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 CYSLTR1 349/4885CYSLTR2 259/4885KCNH2 2716/4885

“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.