SCHEMBL4608527

SCHEMBL4608527

COC(=O)CCc1ccc(Cl)cc1CN1CCN(S(=O)(=O)Cc2ccccc2)[C@@H](C)C1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 18/20 0.75
CCR1 P32246 1/20 0.44
ENPP2 Q13822 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
SCHEMBL4942617 0.92 PTGDR2 (0.63) PTGDR2CCR1ENPP2
SCHEMBL4940295 0.92 PTGDR2 (0.63) PTGDR2CCR1ENPP2
SCHEMBL4622645 0.91 PTGDR2 (0.83) PTGDR2CCR1ENPP2
SCHEMBL4942884 0.90 PTGDR2 (0.60) PTGDR2CCR1ENPP2
SCHEMBL4939937 0.88 PTGDR2 (0.67) PTGDR2CCR1
SCHEMBL4608060 0.86 PTGDR2 (1.00) PTGDR2
SCHEMBL4609205 0.86 PTGDR2 (0.63) PTGDR2
SCHEMBL4934378 0.84 PTGDR2 (0.83) PTGDR2CCR1ENPP2
SCHEMBL4942537 0.84 PTGDR2 (0.71) PTGDR2CCR1ENPP2
SCHEMBL4608191 0.84 PTGDR2 (0.71) PTGDR2CCR1ENPP2

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-20080255150-A1 Novel Compounds ASTRAZENECA AB (SE) 2008-10-16 US disclosed
EP-1948630-A2 NOVEL COMPOUNDS AstraZeneca AB (SE) 2008-07-30 EP disclosed
WO-2007052023-A2 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-05-10 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-20080255150-A1 Novel Compounds CFTR, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP11B2 PTGDR2 620/4885CCR1 535/4885ENPP2 159/4885

“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.