SCHEMBL5007482

SCHEMBL5007482

CC(C)(C)OC(=O)NC(CF)(CF)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
APLNR P35414 1/20 0.38
CTSS P25774 9/20 0.37
CTSK P43235 9/20 0.37
TDP1 Q9NUW8 1/20 0.37
CA1 P00915 3/20 0.36
CA7 P43166 3/20 0.36
CA2 P00918 2/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CA12 O43570 3/20 0.34
CA14 Q9ULX7 3/20 0.34
IDO1 P14902 1/20 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
SCHEMBL7271583 0.88 CTSK (0.38) MEN1GAAKMT2AAPLNRCTSS
SCHEMBL20468220 0.87 AAK1 (0.41) MEN1GAAKMT2AAPLNRCTSS
SCHEMBL8836642 0.82 TDP1 (0.42) MEN1GAAKMT2AAPLNRCTSS
SCHEMBL88462 0.82 CTSK (0.41) MEN1GAAKMT2AAPLNRCTSS
SCHEMBL18482537 0.81 MEN1 (0.34) MEN1GAAKMT2AAPLNRCTSS
SCHEMBL7279185 0.81 MEN1 (0.39) MEN1GAAKMT2AAPLNRCTSS
SCHEMBL28672286 0.81 MEN1 (0.39) MEN1GAAKMT2AAPLNRCTSS
SCHEMBL2279581 0.81 MEN1 (0.39) MEN1GAAKMT2AAPLNRCTSS
SCHEMBL10926854 0.81 MEN1 (0.35) MEN1GAAKMT2ACTSSCTSK
SCHEMBL5408412 0.79 CTSK (0.41) MEN1GAAKMT2ACTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7396846-B2 Growth hormone secretagogues ELI LILLY AND COMPANY (US) 2008-07-08 US disclosed
US-7396846-B2 Growth hormone secretagogues ELI LILLY AND COMPANY (US) 2008-07-08 US disclosed
US-7396846-B2 Growth hormone secretagogues ELI LILLY AND COMPANY (US) 2008-07-08 US disclosed
EP-1497317-B1 DIPEPTIDIC GROWTH HORMONE SECRETAGOGUES LILLY CO ELI (US) 2006-09-06 EP disclosed
US-20060167268-A1 Growth hormone secretagogues ELI LILLY AND COMPANY, PATENT DIVISION, (US) 2006-07-27 US disclosed
EP-1497316-B1 GROWTH HORMONE SECRETAGOGUES LILLY CO ELI (US) 2006-07-05 EP disclosed
US-20050240001-A1 2-(2-Amino-2-methylpropionylamino)-3-(2,6-difluoro-3-methylphenyl)methoxy propionic acid N-[5-(4-chlorophenyl)-3,3-dimethyl-1,1-dioxo-2,3-dihydroisothiazol-4-ylmethyl]-N-ethylamide; endogenous human growth hormone controller; non-peptidyl in nature, more metabolically stable ELI LILLY AND COMPANY (US) 2005-10-27 US disclosed
EP-1497317-A2 DIPEPTIDIC GROWTH HORMONE SECRETAGOGUES ELI LILLY AND COMPANY (US) 2005-01-19 EP disclosed
WO-2003087069-A2 DIPEPTIDIC GROWTH HORMONE SECRETAGOGUES ELI LILLY AND COMPANY (US) 2003-10-23 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-20060167268-A1 Growth hormone secretagogues GHSR, GHRHR, CRH MEN1 119/4885GAA 251/4885KMT2A 3972/4885

“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.