SCHEMBL4533515

SCHEMBL4533515

COc1cc(S(=O)(=O)N2CCC3(CC2)CN(C2CC2)C(=O)CO3)ccc1Br

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FASN P49327 5/20 0.55
L3MBTL1 Q9Y468 1/20 0.46
MCOLN3 Q8TDD5 2/20 0.45
POLB P06746 1/20 0.45
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GPBAR1 Q8TDU6 1/20 0.40
TSHR P16473 1/20 0.40
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL4536273 0.87 FASN (0.57) FASNL3MBTL1MCOLN3POLBLMNA
SCHEMBL4536297 0.86 FASN (0.58) FASNL3MBTL1MCOLN3POLBKDM4E
SCHEMBL4539996 0.85 FASN (0.57) FASNL3MBTL1MCOLN3POLBALDH1A1
SCHEMBL4534422 0.83 FASN (0.55) FASNL3MBTL1POLBLMNAALDH1A1
SCHEMBL4536313 0.83 FASN (0.63) FASNL3MBTL1POLBKDM4ELMNA
SCHEMBL4560548 0.82 FASN (0.55) FASNL3MBTL1MCOLN3POLBALDH1A1
SCHEMBL4541959 0.81 FASN (0.79) FASNL3MBTL1KDM4EALDH1A1SMN1; SMN2
SCHEMBL4533528 0.79 FASN (0.50) FASNL3MBTL1MCOLN3LMNAALDH1A1
SCHEMBL4536504 0.79 FASN (0.72) FASNL3MBTL1KDM4EALDH1A1SMN1; SMN2
SCHEMBL4536955 0.79 FASN (0.58) FASNL3MBTL1KDM4ELMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2637660-A1 FATTY ACID SYNTHASE INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2013-09-18 EP disclosed
US-20130237535-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC 2013-09-12 US disclosed
WO-2012064642-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-05-18 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-20130237535-A1 FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 FASN 1/4885L3MBTL1 4208/4885MCOLN3 4595/4885

“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.