SCHEMBL20593183

SCHEMBL20593183

CC(C)(C)OC(=O)OCc1nc2cc(Br)ccc2n1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 4/20 0.37
PPARG P37231 1/20 0.35
ALOX5AP P20292 8/20 0.35
HDAC6 Q9UBN7 1/20 0.33
ACACB O00763 1/20 0.33

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
SCHEMBL16150279 0.91 CCNB2 (0.37) TBXA2RPPARG
SCHEMBL856144 0.75 TBXA2R (0.39) TBXA2RPPARGALOX5AP
SCHEMBL482970 0.74 BACE1 (0.35) TBXA2R
SCHEMBL31144615 0.72 HTR6 (0.44) TBXA2RPPARGHDAC6
SCHEMBL3756850 0.72 CCNB2 (0.41)
SCHEMBL4442924 0.72 ALOX5AP (0.41) PPARGALOX5APHDAC6
SCHEMBL1300216 0.71 CNR2 (0.38) TBXA2R
SCHEMBL10173079 0.69 CCNB2 (0.39)
SCHEMBL481590 0.68 BACE1 (0.41)
SCHEMBL4527113 0.68 CCNB2 (0.38) TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180370933-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FORMA THERAPEUTICS, INC. 2018-12-27 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-20180370933-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FASN, FABP1, SCD TBXA2R 3105/4885PPARG 737/4885ALOX5AP 149/4885

“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.