SCHEMBL6328866

SCHEMBL6328866

NNC(=O)CCC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 17/20 0.70
MCHR1 Q99705 1/20 0.55
CCR3 P51677 1/20 0.52
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL4040184 0.84 SIGMAR1 (0.74) SIGMAR1MCHR1
SCHEMBL4202919 0.84 SIGMAR1 (0.70) SIGMAR1MCHR1CCR3ALDH1A1
SCHEMBL8023864 0.82 SIGMAR1 (1.00) SIGMAR1CCR3
SCHEMBL6333442 0.82 SIGMAR1 (0.73) SIGMAR1
SCHEMBL6330819 0.79 SIGMAR1 (0.44) SIGMAR1ALDH1A1
SCHEMBL17950892 0.77 SIGMAR1 (0.60) SIGMAR1MCHR1CCR3
SCHEMBL4034703 0.76 SIGMAR1 (0.62) SIGMAR1MCHR1CCR3ALDH1A1
SCHEMBL6327856 0.75 SIGMAR1 (0.71) SIGMAR1MCHR1CCR3ALDH1A1
SCHEMBL17950911 0.75 SIGMAR1 (0.60) SIGMAR1MCHR1CCR3ALDH1A1
SCHEMBL19493171 0.74 SIGMAR1 (0.57) SIGMAR1MCHR1CCR3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6958350-B2 Chemical compounds ASTRAZENECA AB (SE) 2005-10-25 US disclosed
EP-1363902-B1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-09-15 EP disclosed
US-20040102483-A1 Chemical compounds ASTRAZENECA AB (SE) 2004-05-27 US disclosed
EP-1363902-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2003-11-26 EP disclosed
WO-2002066460-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2002-08-29 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-20040102483-A1 Chemical compounds CXCR1, CXCR2, CXCR4 SIGMAR1 269/4885MCHR1 211/4885CCR3 11/4885

“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.