SCHEMBL6011841

SCHEMBL6011841

CC(C(O)=S)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.49
GPR119 Q8TDV5 5/20 0.48
DPP4 P27487 2/20 0.48
RECQL P46063 1/20 0.47
EPHX1 P07099 1/20 0.47
MAPT P10636 2/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MMP13 P45452 2/20 0.43
EED O75530 1/20 0.43
RBBP4 Q09028 1/20 0.43
SUZ12 Q15022 1/20 0.43
EZH2 Q15910 1/20 0.43
AEBP2 Q6ZN18 1/20 0.43

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
SCHEMBL1422213 0.88 HPGD (0.51) HPGDGPR119DPP4RECQLEPHX1
SCHEMBL7493781 0.88 HPGD (0.51) HPGDGPR119DPP4RECQLEPHX1
SCHEMBL8495308 0.86 HPGD (0.53) HPGDGPR119DPP4RECQLEPHX1
SCHEMBL6011839 0.83 HPGD (0.50) HPGDGPR119DPP4RECQLEPHX1
SCHEMBL19450523 0.83 HPGD (0.53) HPGDGPR119DPP4RECQLEPHX1
SCHEMBL6974258 0.82 HPGD (0.55) HPGDGPR119DPP4RECQLEPHX1
SCHEMBL4546601 0.82 HPGD (0.55) HPGDGPR119DPP4RECQLEPHX1
SCHEMBL3821259 0.82 EPHX1 (0.54) HPGDGPR119DPP4RECQLEPHX1
SCHEMBL5341723 0.81 HPGD (0.54) HPGDGPR119DPP4RECQLEPHX1
SCHEMBL470530 0.81 HPGD (0.54) HPGDGPR119DPP4RECQLEPHX1

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-20060189650-A1 Novel piperidine derivatives as modulators of chemokine receptor ccr5 ASTRAZENECA AB (SE) 2006-08-24 US disclosed
EP-1572650-A1 NOVEL PIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR CCR5 AstraZeneca AB (SE) 2005-09-14 EP disclosed
WO-2004056773-A1 NOVEL PIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR CCR5 ASTRAZENECA AB (SE) 2004-07-08 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-20060189650-A1 Novel piperidine derivatives as modulators of chemokine receptor ccr5 CCR5, CCR2, CCR1 HPGD 1464/4885GPR119 142/4885DPP4 2505/4885

“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.