SCHEMBL4511896

SCHEMBL4511896

CC1(OC(=O)N2CCC(CCN3CCN(c4ccc(S(C)(=O)=O)cc4)CC3)CC2)CCC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.53
AKR1C3 P42330 1/20 0.41
DRD2 P14416 2/20 0.41
DRD3 P35462 2/20 0.41
CTSB P07858 2/20 0.41
CTSS P25774 2/20 0.41
CTSK P43235 2/20 0.41
HTR1A P08908 1/20 0.41
HTR2A P28223 1/20 0.41
HTR7 P34969 1/20 0.40
TGFBR1 P36897 1/20 0.40

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
SCHEMBL4514525 0.84 GPR119 (0.74) GPR119TGFBR1
SCHEMBL4507403 0.83 GPR119 (0.58) GPR119
SCHEMBL4504686 0.83 GPR119 (0.69) GPR119TGFBR1
SCHEMBL4507668 0.82 GPR119 (0.54) GPR119AKR1C3DRD2DRD3HTR1A
SCHEMBL4512522 0.79 GPR119 (0.70) GPR119
SCHEMBL1576173 0.79 GPR119 (0.53) GPR119
SCHEMBL4524985 0.76 GPR119 (0.61) GPR119TGFBR1
SCHEMBL4503463 0.75 GPR119 (0.61) GPR119TGFBR1
SCHEMBL4513931 0.75 GPR119 (0.61) GPR119TGFBR1
SCHEMBL4513535 0.75 GPR119 (0.72) GPR119TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090203676-A1 G-protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2009-08-13 US disclosed
US-20090203676-A1 G-protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2009-08-13 US disclosed
US-20090203676-A1 G-protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2009-08-13 US disclosed
EP-1909791-A1 G-PROTEIN COUPLED RECEPTOR AGONISTS Prosidion Limited (GB) 2008-04-16 EP disclosed
WO-2007003964-A1 G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2007-01-11 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-20090203676-A1 G-protein Coupled Receptor Agonists GPR119, GCGR, GPBAR1 GPR119 1/4885AKR1C3 1609/4885DRD2 1031/4885

“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.