SCHEMBL5367113

SCHEMBL5367113

O=C(O)CCCN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 18/20 0.56
CCR3 P51677 18/20 0.56
KCNH2 Q12809 15/20 0.56
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53

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
Hydrochloric Acid SCHEMBL5372445 0.99 HRH1 (0.55) HRH1CCR3KCNH2KDM4EALDH1A1
SCHEMBL5190493 0.93 HRH1 (0.67) HRH1CCR3KCNH2
SCHEMBL5194584 0.90 HRH1 (0.66) HRH1CCR3KCNH2
SCHEMBL5194600 0.89 HRH1 (0.64) HRH1CCR3KCNH2
SCHEMBL5363961 0.87 CCR3 (0.59) HRH1CCR3KCNH2
SCHEMBL5102629 0.85 HRH1 (0.61) HRH1CCR3KCNH2KDM4EALDH1A1
SCHEMBL5102799 0.82 HRH1 (0.59) HRH1CCR3KCNH2KDM4E
SCHEMBL5657070 0.82 CCR3 (0.67) HRH1CCR3KCNH2
SCHEMBL13703552 0.80 FFAR4 (0.56)
SCHEMBL5369447 0.79 HRH1 (0.56) HRH1CCR3KCNH2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7265227-B2 Piperidine derivatives useful as modulators of chemokine receptor activity ASTRAZENECA AB (SE) 2007-09-04 US disclosed
US-20040176411-A1 Piperidine derivatives useful as modulators of chemokine receptor activity ASTRAZENECA AB (SE) 2004-09-09 US disclosed
EP-1412330-A1 PIPERIDINE DERIVATIVES USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY AstraZeneca AB (SE) 2004-04-28 EP disclosed
WO-2003018556-A1 PIPERIDINE DERIVATIVES USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA AB (SE) 2003-03-06 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-20040176411-A1 Piperidine derivatives useful as modulators of chemokine receptor activity CCRL2, CCR1, CCR3 HRH1 27/4885CCR3 3/4885KCNH2 1351/4885

“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.