SCHEMBL6344202

SCHEMBL6344202

CC(C)(C)OC(=O)N(CC(=O)N1CCC(Oc2ccnc(C#N)c2)CC1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.42
MLNR O43193 1/20 0.40
LIPE Q05469 2/20 0.38
SCD O00767 2/20 0.38
LNPEP Q9UIQ6 2/20 0.37
CYP3A4 P08684 1/20 0.36
TTK P33981 1/20 0.36
ALK Q9UM73 1/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
F2 P00734 1/20 0.36
EPHX2 P34913 1/20 0.36
USP30 Q70CQ3 1/20 0.35

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
SCHEMBL4838582 0.80 SIGMAR1 (0.40)
SCHEMBL1698586 0.80 GPR119 (0.64) GPR119ALK
Hydrochloric Acid SCHEMBL6343764 0.79 MLNR (0.38) MLNRSCDCYP3A4TTK
SCHEMBL6345619 0.77 SCD (0.52) SCD
SCHEMBL6215082 0.76 PTPRB (0.43) GPR119USP30
SCHEMBL6354873 0.76 EPHX2 (0.44) GPR119LIPESCDEPHX2USP30
SCHEMBL6353247 0.76 GPR119 (0.42) GPR119LIPEPIK3CD
SCHEMBL1698819 0.76 GPR119 (0.42) GPR119MLNRLNPEPEPHX2
SCHEMBL5393341 0.74 GPR119 (0.34) GPR119SCDUSP30
SCHEMBL6346955 0.73 NOS2 (0.54) GPR119USP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6878725-B2 Serine protease inhibitors ELI LILLY AND COMPANY (US) 2005-04-12 US disclosed
US-20040242656-A1 Serine protease inhibitors LIEBESCHUETZ JOHN WALTER (GB) 2004-12-02 US disclosed
EP-1289950-B1 SERINE PROTEASE INHIBITORS LILLY CO ELI (US) 2004-09-08 EP disclosed
US-20030078438-A1 Serine protease inhibitors ELI LILLY AND COMPANY 2003-04-24 US disclosed
EP-1289950-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2003-03-12 EP disclosed
WO-2001096296-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2001-12-20 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 (2 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-20030078438-A1 Serine protease inhibitors HPN, LPXN, PRSS1 GPR119 2924/4885MLNR 1670/4885LIPE 82/4885
US-20040242656-A1 Serine protease inhibitors SERPINE1, PRSS1, SERPINB1 GPR119 2989/4885MLNR 2109/4885LIPE 116/4885

“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.