SCHEMBL14720671

SCHEMBL14720671

CC(=O)OCCc1ccc(Br)cc1F

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.46
MTNR1B P49286 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
BMP1 P13497 1/20 0.40
DGAT1 O75907 1/20 0.40
PYCR1 P32322 1/20 0.39
AKR1B1 P15121 4/20 0.39
MAPT P10636 2/20 0.39
AKR1A1 P14550 1/20 0.39
FFAR1 O14842 2/20 0.38
P2RX7 Q99572 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL27860277 0.88 ALDH1A1 (0.44) PDPK1ALDH1A1MEN1KMT2ADGAT1
SCHEMBL12069956 0.87 MEN1 (0.46) PDPK1MTNR1BALDH1A1MEN1KMT2A
SCHEMBL28679792 0.84 DGAT1 (0.47) PDPK1MTNR1BMEN1KMT2ABMP1
SCHEMBL25840109 0.84 MAOB (0.52) ALDH1A1MAOB
SCHEMBL13034145 0.84 MEN1 (0.53) PDPK1MTNR1BALDH1A1MEN1KMT2A
SCHEMBL27615919 0.80 MTNR1B (0.46) PDPK1MTNR1BALDH1A1BMP1DGAT1
SCHEMBL14720326 0.79 RAD52 (0.43) ALDH1A1DGAT1
SCHEMBL3883372 0.79 PDPK1 (0.56) PDPK1MTNR1BBMP1DGAT1PYCR1
SCHEMBL1241995 0.78 ALDH1A1 (0.44) ALDH1A1MEN1KMT2A
SCHEMBL25840107 0.77 MAOB (0.50) ALDH1A1MEN1KMT2AMAOB

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 PDPK1 435/4885MTNR1B 3877/4885ALDH1A1 137/4885

“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.