SCHEMBL12896294

SCHEMBL12896294

Cc1ccccc1C1CC(Br)=NO1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 11/20 0.44
TAAR1 Q96RJ0 1/20 0.41
HTR2C P28335 3/20 0.37
HTR2A P28223 1/20 0.37
HTR2B P41595 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL12896385 1.00 TEAD1 (0.44) TEAD1TAAR1HTR2CHTR2AHTR2B
SCHEMBL12896383 1.00 TEAD1 (0.44) TEAD1TAAR1HTR2CHTR2AHTR2B
SCHEMBL12305016 0.86 TAAR1 (0.44) TAAR1HTR2CHTR2AHTR2BMAOA
SCHEMBL2740638 0.86 TAAR1 (0.44) TAAR1HTR2CHTR2AHTR2BMAOA
SCHEMBL12923754 0.80 CYP19A1 (0.42) TEAD1HTR2CHTR2AHTR2B
SCHEMBL12923876 0.80 CYP19A1 (0.42) TEAD1HTR2CHTR2AHTR2B
SCHEMBL12923877 0.80 CYP19A1 (0.42) TEAD1HTR2CHTR2AHTR2B
SCHEMBL12595267 0.79 TAAR1 (0.49) TAAR1HTR2CHTR2AHTR2BMAOA
SCHEMBL12896371 0.79 TP53 (0.42) TEAD1TAAR1HTR2CHTR2AHTR2B
SCHEMBL12896288 0.79 TP53 (0.42) TEAD1TAAR1HTR2CHTR2AHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9149465-B2 Isoxazolines as inhibitors of fatty acid amide hydrolase INFINITY PHARMACEUTICALS, INC. (US) 2015-10-06 US disclosed
US-20110028478-A1 ISOXAZOLINES AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. (US) 2011-02-03 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-20110028478-A1 ISOXAZOLINES AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, HRH2 TEAD1 2965/4885TAAR1 620/4885HTR2C 359/4885

“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.