SCHEMBL3177946

SCHEMBL3177946

CS(=O)(=O)N1CCc2cc(OCCCc3ccc(O)cc3)ccc2C1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 3/20 0.62
ESR1 P03372 2/20 0.62
HRH3 Q9Y5N1 7/20 0.57
S1PR1 P21453 5/20 0.43
MOGAT2 Q3SYC2 2/20 0.41
ACACB O00763 1/20 0.41

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
SCHEMBL3171545 0.89 HRH3 (0.57) ESR2ESR1HRH3S1PR1MOGAT2
SCHEMBL3177276 0.88 ESR2 (0.58) ESR2ESR1HRH3MOGAT2
SCHEMBL3176578 0.87 HRH3 (0.55) ESR2ESR1HRH3MOGAT2
SCHEMBL3181201 0.87 HRH3 (0.55) ESR2ESR1HRH3MOGAT2ACACB
SCHEMBL3180942 0.86 HRH3 (0.54) ESR2ESR1HRH3S1PR1MOGAT2
SCHEMBL3188279 0.86 HRH3 (0.52) ESR2ESR1HRH3S1PR1MOGAT2
SCHEMBL3180738 0.85 HRH3 (0.53) ESR2ESR1HRH3S1PR1MOGAT2
SCHEMBL3171901 0.84 HRH3 (0.53) ESR2ESR1HRH3MOGAT2
SCHEMBL3188313 0.84 HRH3 (0.53) ESR2ESR1HRH3MOGAT2
SCHEMBL3181908 0.83 HRH3 (0.52) ESR2ESR1HRH3S1PR1MOGAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100022515-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2010-01-28 US claimed
EP-2114890-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-11-11 EP claimed
WO-2008097428-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2008-08-14 WO claimed
US-20100022515-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2010-01-28 US disclosed
US-20100022515-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2010-01-28 US disclosed
US-20100022515-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2010-01-28 US disclosed
EP-2114890-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-11-11 EP disclosed
WO-2008097428-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2008-08-14 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-20100022515-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY GPR119, GCGR, GPR65 ESR2 218/4885ESR1 638/4885HRH3 665/4885

“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.