SCHEMBL5870646

SCHEMBL5870646

CC(C)(C)OC(=O)N1CC2CCC1C/C2=C/c1ccc(Cl)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
OPRK1 P41145 1/20 0.40
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL5870649 1.00 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3OPRK1ALDH1A1
SCHEMBL5870650 0.77 CHRM2 (0.44) SLC6A2SLC6A4SLC6A3OPRK1ALDH1A1
SCHEMBL6939247 0.74 AKR1C3 (0.43) ALDH1A1
SCHEMBL4959967 0.70 ESR2 (0.46) MAPK1
SCHEMBL17628835 0.69 CHRM2 (0.45)
SCHEMBL31694656 0.69 CHRM2 (0.45)
SCHEMBL17639926 0.69 CHRM2 (0.45)
SCHEMBL5870651 0.68 CCR3 (0.49) OPRK1ALDH1A1
SCHEMBL7412171 0.67 OPRK1 (0.46) SLC6A3OPRK1ALDH1A1
SCHEMBL30479117 0.67 CHRM2 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060194790-A1 Bridged bicyclic amine derivatives useful as CCR-3 receptor antagonists GONG LEYI 2006-08-31 US disclosed
US-20060189596-A1 Bridged bicyclic amine derivatives useful as CCR-3 receptor antagonists GONG LEYI 2006-08-24 US disclosed
US-7081531-B2 Bridged bicyclic amine derivatives useful as CCR-3 receptor antagonists ROCHE PALO ALTO LLC (US) 2006-07-25 US disclosed
EP-1599472-A1 CCR-3 RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-11-30 EP disclosed
WO-2004076448-A1 CCR-3 RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-09-10 WO disclosed
US-20040176416-A1 Bridged bicyclic amine derivatives useful as CCR-3 receptor antagonists ROCHE PALO ALTO LLC 2004-09-09 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 (3 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-20060189596-A1 Bridged bicyclic amine derivatives useful as CCR-3 receptor antagonists CCR3, CCR10, CCR1 SLC6A2 2346/4885SLC6A4 2246/4885SLC6A3 1381/4885
US-20040176416-A1 Bridged bicyclic amine derivatives useful as CCR-3 receptor antagonists CCR3, CCR1, CCR10 SLC6A2 1955/4885SLC6A4 1637/4885SLC6A3 1442/4885
US-20060194790-A1 Bridged bicyclic amine derivatives useful as CCR-3 receptor antagonists CCR3, CCR10, CCR1 SLC6A2 1937/4885SLC6A4 1319/4885SLC6A3 1105/4885

“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.