SCHEMBL8054496

SCHEMBL8054496

Cc1nc(C(=O)N2CCCC[C@H]2CNC(=O)OC(C)(C)C)c(-c2ccc(F)cc2)s1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 20/20 0.66
HCRTR2 O43614 13/20 0.66

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
SCHEMBL1398823 0.94 HCRTR1 (0.57) HCRTR1HCRTR2
SCHEMBL3002221 0.92 HCRTR1 (0.55) HCRTR1HCRTR2
SCHEMBL3002218 0.92 HCRTR1 (0.55) HCRTR1HCRTR2
SCHEMBL3361881 0.90 HCRTR1 (0.54) HCRTR1HCRTR2
SCHEMBL3361884 0.90 HCRTR1 (0.54) HCRTR1HCRTR2
SCHEMBL2883132 0.89 HCRTR1 (0.71) HCRTR1HCRTR2
SCHEMBL1398706 0.87 HCRTR1 (0.49) HCRTR1HCRTR2
SCHEMBL15184253 0.86 HCRTR1 (0.68) HCRTR1HCRTR2
SCHEMBL1398787 0.85 HCRTR1 (0.56) HCRTR1HCRTR2
SCHEMBL1596937 0.85 HCRTR1 (0.68) HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100286201-A1 POLYMORPH FORMS OF (S)-2-((4-BENZOFURANYL)CARBONYLAMINOMETHYL)-1-((4-(2-METHYL-5-(4-FLUOROPHENYL)THIAZOLYL)CARBONYL)PIPERIDINE GLAXO GROUP LIMITED (GB) 2010-11-11 US disclosed
WO-2009034133-A1 POLYMORPH FORMS OF (S)-2-((4-BENZOFURANYL)CARBONYLAMINOMETHYL)-1-((4-(2-METHYL-5-(4-FLUOROPHENYL)THIAZOLYL)CARBONYL)PIPERIDINE GLAXO GROUP LIMITED (GB) 2009-03-19 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-20100286201-A1 POLYMORPH FORMS OF (S)-2-((4-BENZOFURANYL)CARBONYLAMINOMETHYL)-1-((4-(2-METHYL-5-(4-FLUOROPHENYL)THIAZOLYL)CARBONYL)PIPERIDINE HLA-DRB1, HLA-C, BRCA1 HCRTR1 4137/4885HCRTR2 3700/4885

“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.