SCHEMBL5870650

SCHEMBL5870650

CC(C)(C)OC(=O)N1C2CCC1CC(=Cc1ccc(Cl)c(Cl)c1)C2

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HSD11B1 P28845 1/20 0.41
OPRK1 P41145 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
GPR119 Q8TDV5 1/20 0.37
PREP P48147 1/20 0.37
SUV39H2 Q9H5I1 1/20 0.36
JAK1 P23458 1/20 0.36

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
SCHEMBL5870689 0.86 CHRM2 (0.47) CHRM2CHRM1CHRM3HSD11B1GPR119
SCHEMBL3888021 0.81 CHRM2 (0.47) CHRM2CHRM1CHRM3HSD11B1GPR119
SCHEMBL4959967 0.78 ESR2 (0.46) MAPK1GPR119
SCHEMBL5870649 0.77 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3OPRK1ALDH1A1
SCHEMBL5870646 0.77 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3OPRK1ALDH1A1
SCHEMBL5870725 0.73 CHRM2 (0.49) CHRM2CHRM1CHRM3HSD11B1OPRK1
SCHEMBL6943848 0.72 PPARG (0.43) CHRM1ALDH1A1
SCHEMBL24208627 0.71 CHRM2 (0.53) CHRM2CHRM1CHRM3HSD11B1ALDH1A1
SCHEMBL30777200 0.71 CHRM2 (0.53) CHRM2CHRM1CHRM3HSD11B1ALDH1A1
SCHEMBL12094583 0.71 GPR119 (0.46) CHRM2CHRM1CHRM3HSD11B1ALDH1A1

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 CHRM2 207/4885CHRM1 177/4885CHRM3 40/4885
US-20040176416-A1 Bridged bicyclic amine derivatives useful as CCR-3 receptor antagonists CCR3, CCR1, CCR10 CHRM2 155/4885CHRM1 134/4885CHRM3 18/4885
US-20060194790-A1 Bridged bicyclic amine derivatives useful as CCR-3 receptor antagonists CCR3, CCR10, CCR1 CHRM2 83/4885CHRM1 61/4885CHRM3 13/4885

“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.