SCHEMBL5568808

SCHEMBL5568808

CC(C)(C)OC(=O)N1CCC(NS(=O)(=O)CCc2cccc(Cl)c2Cl)CC1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
STS P08842 6/20 0.54
BRD4 O60885 1/20 0.46
MAPT P10636 2/20 0.44
ALDH1A1 P00352 2/20 0.44
CCR8 P51685 1/20 0.44
NPC1 O15118 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
EPHX2 P34913 2/20 0.44
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
GPR119 Q8TDV5 1/20 0.42
SFRP1 Q8N474 1/20 0.42
LMNA P02545 1/20 0.42
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN6 P29350 1/20 0.42

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
SCHEMBL4768017 0.83 STS (0.52) STSMAPTGPR119PTPN2PTPN1
SCHEMBL5994005 0.81 STS (0.54) STSMAPTALDH1A1NPC1MAPK1
SCHEMBL4783289 0.81 STS (0.63) STSBRD4MAPTALDH1A1CCR8
SCHEMBL4770596 0.79 PTPRB (0.44) STSMAPTALDH1A1LMNA
SCHEMBL5567927 0.78 STS (0.45) STSBRD4MAPTLMNA
SCHEMBL5568092 0.78 NPSR1 (0.51) ALDH1A1HTTLMNA
SCHEMBL18424597 0.77 ALDH1A1 (0.45) STSBRD4ALDH1A1CCR8EPHX2
SCHEMBL16846251 0.76 STS (0.61) STSBRD4MAPTALDH1A1CCR8
SCHEMBL5568810 0.75 STS (0.53) STSMAPTGPR119
SCHEMBL18423641 0.75 DPP4 (0.45) STSALDH1A1CCR8EPHX2GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US claimed
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US 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-20070135435-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 STS 4478/4885BRD4 780/4885MAPT 294/4885

“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.