SCHEMBL1003971

SCHEMBL1003971

CCc1cnc(N2CCC(Oc3ccc(CO)cc3Cl)CC2)nc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCD O00767 5/20 0.46
GPR119 Q8TDV5 11/20 0.45
CSNK2A1 P68400 2/20 0.43
FPR2 P25090 1/20 0.39
PROKR1 Q8TCW9 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL1005428 0.90 SCD (0.47) SCDGPR119CSNK2A1FPR2PROKR1
SCHEMBL12239172 0.85 SMN1; SMN2 (0.43) SCDGPR119CSNK2A1
SCHEMBL12239187 0.85 CSNK2A1 (0.45) SCDGPR119CSNK2A1
SCHEMBL12239176 0.85 CSNK2A1 (0.45) SCDGPR119CSNK2A1FPR2PROKR1
SCHEMBL12239186 0.85 SCD (0.42) SCDGPR119CSNK2A1
SCHEMBL1006023 0.84 GPR119 (0.47) SCDGPR119FPR2PROKR1KCNH2
SCHEMBL12239188 0.84 GPR119 (0.42) SCDGPR119CSNK2A1
SCHEMBL12262498 0.84 SCN8A (0.42) SCDGPR119CSNK2A1
SCHEMBL1007710 0.84 UTS2R (0.47) KCNH2
SCHEMBL1003936 0.83 GPR119 (0.46) SCDGPR119

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-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-27 US disclosed
US-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-27 US disclosed
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
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 SCD 1145/4885GPR119 1/4885CSNK2A1 988/4885

“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.