SCHEMBL4558342

SCHEMBL4558342

COc1ccc(C[AsH]c2c(-c3ccccc3)c(=O)[nH]c3cc(Cl)c(C#N)cc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FASN P49327 12/20 0.56
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
RAD51 Q06609 1/20 0.38
PDE2A O00408 1/20 0.38
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
BLM P54132 1/20 0.37

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
SCHEMBL4464161 0.82 FASN (0.56) FASNMAOAMAOBRAD51
SCHEMBL4469054 0.74 FASN (0.77) FASNMAOAMAOB
SCHEMBL4469630 0.73 FASN (0.76) FASNMAOAMAOB
SCHEMBL4457132 0.73 FASN (0.76) FASNMAOAMAOB
SCHEMBL4452981 0.72 FASN (1.00) FASN
SCHEMBL4456012 0.71 FASN (0.64) FASNMAOAMAOB
SCHEMBL4455113 0.67 FASN (1.00) FASN
SCHEMBL4456703 0.67 FASN (0.82) FASNPDE2A
SCHEMBL13936068 0.67 FASN (1.00) FASN
SCHEMBL12686482 0.66 FASN (0.57) FASNCYP1A2POLBCYP3A4CYP2C9

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-20090048276-A1 Inhibitors of Fatty Acid Synthase (Fas) MERCK SHARP & DOHME CORP. 2009-02-19 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-20090048276-A1 Inhibitors of Fatty Acid Synthase (Fas) FASN, FADS2, FADS1 FASN 1/4885MAOA 1459/4885MAOB 1379/4885

“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.