SCHEMBL1128619

SCHEMBL1128619

O=C(c1ccccc1)c1ccc2cc(Br)ccc2n1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.66
ALDH1A1 P00352 1/20 0.48
MAPT P10636 2/20 0.47
POLB P06746 1/20 0.47
HSD17B14 Q9BPX1 3/20 0.46
MGAM O43451 1/20 0.45
BACE1 P56817 1/20 0.45
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.42
KDM4E B2RXH2 2/20 0.42
HDAC8 Q9BY41 1/20 0.41
KMT2A Q03164 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL1000331 0.82 MGAM (0.56) ALDH1A1MGAMBACE1ALOX15HTT
SCHEMBL7832199 0.80 CNR2 (1.00) CNR2ALDH1A1MAPTHSD17B14MGAM
SCHEMBL30227109 0.80 CNR2 (1.00) CNR2ALDH1A1MAPTHSD17B14MGAM
SCHEMBL12419219 0.79 CNR2 (0.62) CNR2ALDH1A1MAPTHSD17B14MGAM
SCHEMBL27838449 0.78 CNR2 (0.96) CNR2ALDH1A1MAPTHSD17B14MGAM
SCHEMBL262639 0.77 BACE1 (0.50) ALDH1A1BACE1HTTABCG2HDAC8
SCHEMBL13791878 0.77 BACE1 (0.50) ALDH1A1HSD17B14MGAMBACE1ABCG2
SCHEMBL16093684 0.77 BACE1 (0.55) ALDH1A1BACE1ABCG2KDM4EHDAC8
Hydrochloric Acid SCHEMBL3880519 0.76 BACE1 (0.49) ALDH1A1HSD17B14MGAMBACE1ABCG2
SCHEMBL30345311 0.76 CNR2 (0.65) CNR2MAPTHSD17B14KDM4EHDAC8

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
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
CN-102046179-B Inhibitors of fatty acid amide hydrolase INFINITY PHARMACEUTICALS INC 2015-01-14 CN disclosed
US-20110172186-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. 2011-07-14 US disclosed
CN-102046179-A Inhibitors of fatty acid amide hydrolase INFINITY PHARMACEUTICALS INC 2011-05-04 CN 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 CNR2 30/4885ALDH1A1 354/4885MAPT 3395/4885
US-20150368278-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 CNR2 30/4885ALDH1A1 354/4885MAPT 3395/4885

“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.