SCHEMBL1928546

SCHEMBL1928546

Cc1c(OC2CCN(C[C@H](O)CN)CC2)ccc(C#N)c1Cl

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 11/20 0.51
CCR3 P51677 11/20 0.51
KCNH2 Q12809 3/20 0.51
AR P10275 2/20 0.41
HRH3 Q9Y5N1 1/20 0.40
DRD2 P14416 3/20 0.38
DRD4 P21917 3/20 0.38
DRD3 P35462 3/20 0.38
CYP2C19 P33261 1/20 0.37

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
SCHEMBL1928549 1.00 HRH1 (0.51) HRH1CCR3KCNH2ARHRH3
SCHEMBL1929589 0.86 HRH1 (0.50) HRH1CCR3KCNH2DRD2DRD4
SCHEMBL5986597 0.81 CCR3 (0.54) HRH1CCR3KCNH2DRD2DRD4
SCHEMBL1929113 0.81 CCR3 (0.54) HRH1CCR3KCNH2DRD2DRD4
SCHEMBL180150 0.80 HRH1 (0.61) HRH1CCR3KCNH2AR
SCHEMBL3282697 0.79 HRH1 (0.57) HRH1CCR3KCNH2ARHRH3
SCHEMBL3282702 0.79 HRH1 (0.57) HRH1CCR3KCNH2ARHRH3
SCHEMBL180043 0.78 HRH1 (0.58) HRH1CCR3KCNH2ARHRH3
SCHEMBL1929697 0.77 HRH1 (0.54) HRH1CCR3KCNH2DRD2DRD4
SCHEMBL6648874 0.77 HRH1 (0.54) HRH1CCR3KCNH2DRD2DRD4

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-7956070-B2 Piperidines as chemokine modulators (CCR) ASTRAZENECA AB (SE) 2011-06-07 US disclosed
US-20070054924-A1 Novel piperidines as chemokine modulators (ccr) ASTRAZENECA AB (SE) 2007-03-08 US disclosed
EP-1713772-A1 NOVEL PIPERIDINES AS CHEMOKINE MODULATORS (CCR) AstraZeneca AB (SE) 2006-10-25 EP disclosed
WO-2005073192-A1 NOVEL PIPERIDINES AS CHEMOKINE MODULATORS (CCR) ASTRAZENECA AB (SE) 2005-08-11 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-20070054924-A1 Novel piperidines as chemokine modulators (ccr) CCR3, CCR1, CCR4 HRH1 81/4885CCR3 1/4885KCNH2 2399/4885

“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.