SCHEMBL4140558

SCHEMBL4140558

Cc1c(Cl)ccc(OC2CCN(CC3CCN([C@@H](Cc4ccccc4)C(=O)O)CC3)CC2)c1Cl

nearest known ligand 0.87

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 20/20 0.87
CCR3 P51677 20/20 0.87
KCNH2 Q12809 9/20 0.71

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
SCHEMBL4149277 1.00 HRH1 (0.87) HRH1CCR3KCNH2
SCHEMBL14110547 0.93 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL180270 0.93 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL180025 0.93 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL4157116 0.92 HRH1 (0.74) HRH1CCR3KCNH2
SCHEMBL180032 0.92 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL180286 0.92 HRH1 (0.98) HRH1CCR3KCNH2
Hydrochloric Acid SCHEMBL14110672 0.92 HRH1 (0.98) HRH1CCR3KCNH2
SCHEMBL14110640 0.89 HRH1 (0.77) HRH1CCR3KCNH2
SCHEMBL180046 0.89 HRH1 (0.92) HRH1CCR3KCNH2

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
EP-1620400-B1 piperidinylmethylpiperidine derivatives and their use as chemokine modulators ASTRAZENECA AB (SE) 2012-12-05 EP disclosed
US-20090118513-A1 Chemical Compounds ASTRAZENECA AB (SE) 2009-05-07 US disclosed
US-7495013-B2 Chemical compounds ASTRAZENECA AB (SE) 2009-02-24 US disclosed
US-20070032523-A1 Chemical compounds ASTRAZENECA AB (SE) 2007-02-08 US disclosed
EP-1620400-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2006-02-01 EP disclosed
WO-2004087659-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-10-14 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 (2 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-20090118513-A1 Chemical Compounds CCR3, CCR1, CCR4 HRH1 38/4885CCR3 1/4885KCNH2 4039/4885
US-20070032523-A1 Chemical compounds CCR3, CCR1, CCR4 HRH1 35/4885CCR3 1/4885KCNH2 3562/4885

“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.