SCHEMBL11063

SCHEMBL11063

O=C(O)c1ccc2nc(-c3ccc(-c4ccc(F)cc4)cc3)n(C[C@H]3CCN(C(=O)C4CC4)C3)c2c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FASN P49327 6/20 0.47
BRD4 O60885 10/20 0.45
PTGER4 P35408 3/20 0.44
VDR P11473 1/20 0.43
NR1H4 Q96RI1 1/20 0.43

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
SCHEMBL11062 1.00 FASN (0.47) FASNBRD4PTGER4VDRNR1H4
SCHEMBL10794 0.92 FASN (0.52) FASNBRD4
SCHEMBL10795 0.92 FASN (0.52) FASNBRD4
SCHEMBL9921 0.90 BRD4 (0.46) FASNBRD4PTGER4VDRNR1H4
SCHEMBL9920 0.90 BRD4 (0.46) FASNBRD4PTGER4VDRNR1H4
SCHEMBL13600 0.90 FASN (0.46) FASNBRD4PTGER4
SCHEMBL11909657 0.90 BRD4 (0.51) FASNBRD4PTGER4
SCHEMBL22220913 0.90 BRD4 (0.51) FASNBRD4PTGER4
SCHEMBL13599 0.90 FASN (0.46) FASNBRD4PTGER4
SCHEMBL13895 0.90 BRD4 (0.51) FASNBRD4PTGER4

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-2493310-A1 BENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS GlaxoSmithKline LLC (US) 2012-09-05 EP disclosed
US-20120208827-A1 BENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC 2012-08-16 US disclosed
WO-2011056635-A1 BENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-05-12 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-20120208827-A1 BENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 FASN 1/4885BRD4 277/4885PTGER4 2567/4885

“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.