SCHEMBL4515655

SCHEMBL4515655

CCC(=O)Nc1ccc(N2CCN(CCC3CCC(C(=O)OC(C)(C)C)CC3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
HTT P42858 1/20 0.51
DRD2 P14416 5/20 0.47
DRD3 P35462 4/20 0.47
LMNA P02545 3/20 0.47
GAA P10253 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
MAPT P10636 4/20 0.46
CACNA1G O43497 1/20 0.45
USP2 O75604 1/20 0.44
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL4511501 0.85 DRD2 (0.48) SMN1; SMN2DRD2DRD3GAAMAPT
SCHEMBL4516920 0.82 MAPT (0.56) SMN1; SMN2DRD2DRD3LMNAMAPT
SCHEMBL4518131 0.80 PTPN2 (0.62) SMN1; SMN2HTTDRD2DRD3LMNA
SCHEMBL13757761 0.79 MAPT (0.54) SMN1; SMN2HTTLMNAGAARXFP1
SCHEMBL4507999 0.79 GPR119 (0.53) SMN1; SMN2HTTLMNAMAPTTSHR
SCHEMBL4518794 0.77 GPR119 (0.51) SMN1; SMN2HTTLMNAGAARXFP1
SCHEMBL4516443 0.77 GPR119 (0.51) SMN1; SMN2HTTDRD2DRD3LMNA
SCHEMBL4514501 0.77 GPR119 (0.51) SMN1; SMN2HTTLMNAMAPTTSHR
SCHEMBL13757766 0.77 PTPN2 (0.58) SMN1; SMN2HTTDRD2DRD3LMNA
SCHEMBL13757744 0.76 GPR119 (0.55) SMN1; SMN2HTTDRD2DRD3LMNA

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 4 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
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 SMN1; SMN2 3393/4885HTT 4058/4885DRD2 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.