SCHEMBL4540336

SCHEMBL4540336

O=C1COC2(CCN(S(=O)(=O)c3ccc(Br)c(Cl)c3F)CC2)CN1C1CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FASN P49327 5/20 0.48
TSHR P16473 4/20 0.34
HTT P42858 2/20 0.34
MAPK1 P28482 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
CCR1 P32246 5/20 0.32
ATM Q13315 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL4533528 0.83 FASN (0.50) FASNTSHRHTTMAPK1SMN1; SMN2
SCHEMBL4542521 0.83 FASN (0.52) FASNTSHRHTTMAPK1SMN1; SMN2
SCHEMBL4536297 0.82 FASN (0.58) FASNTSHRHTTMAPK1SMN1; SMN2
SCHEMBL4534373 0.82 FASN (0.51) FASNMAPK1LMNACCR1NPC1
SCHEMBL4539996 0.81 FASN (0.57) FASNTSHRMAPK1SMN1; SMN2NPC1
SCHEMBL4540544 0.81 FASN (0.50) FASNHTTMAPK1SMN1; SMN2CCR1
SCHEMBL4561709 0.79 FASN (0.49) FASN
SCHEMBL4536313 0.78 FASN (0.63) FASNTSHRHTTMAPK1SMN1; SMN2
SCHEMBL4542291 0.78 FASN (0.51) FASNSMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL4533595 0.78 FASN (0.55) FASNTSHRMAPK1SMN1; SMN2NPC1

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 1/4885TSHR 3054/4885HTT 3758/4885

“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.