SCHEMBL3948076

SCHEMBL3948076

CC(C)(C)OC(=O)N1CCCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)C1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 19/20 0.59
▸ CCR3 P51677 19/20 0.59
▸ KCNH2 Q12809 16/20 0.59

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
SCHEMBL4140781 0.88 HRH1 (0.64) HRH1CCR3KCNH2
SCHEMBL6620599 0.85 HRH1 (0.59) HRH1CCR3KCNH2
SCHEMBL5462103 0.85 GPR119 (0.58) HRH1CCR3KCNH2
SCHEMBL3939817 0.83 HRH1 (0.61) HRH1CCR3KCNH2
SCHEMBL3940636 0.83 HRH1 (0.61) HRH1CCR3KCNH2
SCHEMBL3282383 0.82 GPR119 (0.59) HRH1CCR3KCNH2
SCHEMBL1943087 0.81 CCR2 (0.57) KCNH2
SCHEMBL5189718 0.80 HRH1 (0.68) HRH1CCR3KCNH2
SCHEMBL12539489 0.80 CCR2 (0.73) KCNH2
SCHEMBL5194646 0.78 CCR3 (0.47) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7517989-B2 Piperidine derivatives useful as modulators of chemokine receptor activity ASTRAZENECA AB (SE) 2009-04-14 — — US disclosed
US-20090069325-A1 Piperidine Derivatives Useful as Modulators of Chemokine Receptor Activity ASTRAZENECA AB (SE) 2009-03-12 — — US disclosed
US-20050176708-A1 Piperidine derivatives useful as modulators of chemokine receptor activity ASTRAZENECA AB (SE) 2005-08-11 — — US disclosed
EP-1487793-A1 PIPERIDINE DERIVATIVES USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY AstraZeneca AB (SE) 2004-12-22 — — EP disclosed
WO-2003078395-A1 PIPERIDINE DERIVATIVES USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA AB (SE) 2003-09-25 — — 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-20050176708-A1 Piperidine derivatives useful as modulators of chemokine receptor activity CCR3, CCR1, ACKR3 HRH1 46/4885CCR3 1/4885KCNH2 2355/4885
US-20090069325-A1 Piperidine Derivatives Useful as Modulators of Chemokine Receptor Activity CCR3, CCR1, CCR5 HRH1 37/4885CCR3 1/4885KCNH2 2489/4885

“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.

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