SCHEMBL1004545

SCHEMBL1004545

CCc1cnc(N2CCC(Oc3ccc(CN4CCN(C(=O)O)CC4=O)cc3Cl)CC2)nc1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.41
UTS2R Q9UKP6 13/20 0.39
EPHX2 P34913 1/20 0.37
SCD O00767 1/20 0.37
DPP4 P27487 1/20 0.36

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
SCHEMBL2549098 0.90 PIK3CD (0.40) GPR119UTS2R
SCHEMBL1006144 0.89 GPR119 (0.39) GPR119UTS2RSCD
SCHEMBL1003933 0.87 UTS2R (0.49) UTS2R
SCHEMBL1005476 0.85 GPR119 (0.46) GPR119
SCHEMBL12239179 0.85 GPR119 (0.44) GPR119SCD
SCHEMBL1005653 0.83 GPR119 (0.43) GPR119UTS2RSCD
SCHEMBL1006510 0.82 GPR119 (0.41) GPR119UTS2REPHX2SCD
SCHEMBL1003971 0.79 SCD (0.46) GPR119SCD
SCHEMBL2549095 0.79 GPR119 (0.39) GPR119SCD
SCHEMBL2546078 0.79 UTS2R (0.46) GPR119UTS2R

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
US-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-27 US disclosed
EP-2271619-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-01-12 EP disclosed
WO-2009126535-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-10-15 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-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY GPR119, GPR55, NR1H2 GPR119 1/4885UTS2R 265/4885EPHX2 1379/4885

“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.