SCHEMBL10320

SCHEMBL10320

Nc1cc(Br)c(F)cc1NC[C@@H]1CCN(C(=O)C2CC2)C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.38
TDO2 P48775 1/20 0.38
GAA P10253 1/20 0.37
HDAC2 Q92769 1/20 0.36
EPHX2 P34913 1/20 0.36
NPY5R Q15761 1/20 0.35
FASN P49327 6/20 0.35
PARP1 P09874 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
F10 P00742 3/20 0.34

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
SCHEMBL11909959 0.83 MAPT (0.37) IDO1TDO2GAAEPHX2NPY5R
SCHEMBL4030 0.82 HDAC2 (0.48) GAAHDAC2NPY5RFASN
SCHEMBL4032 0.82 HDAC2 (0.48) GAAHDAC2NPY5RFASN
SCHEMBL11953 0.82 NPY5R (0.44) GAAHDAC2NPY5RFASN
SCHEMBL5952 0.78 PTGER4 (0.41) IDO1TDO2FASNF10
SCHEMBL11908825 0.78 USP30 (0.39) IDO1TDO2HDAC2FASNKMT2A
SCHEMBL11908275 0.78 PTGER4 (0.46) IDO1TDO2KMT2A
SCHEMBL12076614 0.78 PTGER4 (0.46) IDO1TDO2KMT2A
SCHEMBL10580 0.77 LIPC (0.48) GAAEPHX2POLBKMT2A
SCHEMBL12076494 0.77 LIPC (0.48) GAAEPHX2POLBKMT2A

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 IDO1 1965/4885TDO2 2651/4885GAA 552/4885

“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.