SCHEMBL14720436

SCHEMBL14720436

CC(=O)OCC(Br)c1c(F)cc(Br)cc1F

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 2/20 0.34
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
AAK1 Q2M2I8 2/20 0.33
ABCB1 P08183 1/20 0.32
DGAT1 O75907 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 2/20 0.31
ACACB O00763 1/20 0.31
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL14720320 0.80 APLNR (0.41) TDP1MAPTCYP4F2CYP4A11AAK1
SCHEMBL27900437 0.71 CYP1A2 (0.46) MAPTMAPK1ALDH1A1KMT2ANPSR1
SCHEMBL14720326 0.70 RAD52 (0.43) DGAT1ALDH1A1TSHR
SCHEMBL15076851 0.69 ALDH1A1 (0.37) MAPTCYP4F2CYP4A11DGAT1ALDH1A1
SCHEMBL16207488 0.68 AAK1 (0.38) MAPTAAK1DGAT1ALDH1A1KMT2A
SCHEMBL31691297 0.67 ALDH1A1 (0.35) ALDH1A1ACACBL3MBTL1
SCHEMBL4928416 0.66 CYP4F2 (0.40) MAPTCYP4F2CYP4A11DGAT1MAPK1
SCHEMBL2302000 0.66 ALDH1A1 (0.48) ALDH1A1KMT2ANPSR1TSHR
SCHEMBL4293759 0.66 ALDH1A1 (0.48) ALDH1A1KMT2ANPSR1TSHR
SCHEMBL1094278 0.66 LMNA (0.33) TDP1MAPTMAPK1ALDH1A1KMT2A

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
EP-2744333-B1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2016-10-05 EP disclosed
US-9084794-B2 Fatty acid synthase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2015-07-21 US disclosed
US-20140194415-A1 FATTY ACID SYNTHASE INHIBITORS GlaxoSmithKline Intellectual Property (No2) Limite (GB) 2014-07-10 US disclosed
EP-2744333-A1 FATTY ACID SYNTHASE INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2014-06-25 EP disclosed
WO-2013028447-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-02-28 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 (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-20140194415-A1 FATTY ACID SYNTHASE INHIBITORS FASN, FADS2, FADS1 TDP1 3901/4885MAPT 4695/4885CYP4F2 631/4885

“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.