SCHEMBL5191328

SCHEMBL5191328

O=C(O)C(c1ccccc1)N1CCC(O)(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 20/20 0.72
▸ CCR3 P51677 20/20 0.72
▸ KCNH2 Q12809 13/20 0.72

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
SCHEMBL5192663 0.92 HRH1 (0.61) HRH1CCR3KCNH2
SCHEMBL5194895 0.88 CCR3 (0.57) HRH1CCR3KCNH2
SCHEMBL5189859 0.84 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL5190328 0.84 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL5191532 0.84 HRH1 (1.00) HRH1CCR3KCNH2
Hydrochloric Acid SCHEMBL5196571 0.83 HRH1 (0.98) HRH1CCR3KCNH2
Hydrochloric Acid SCHEMBL5194871 0.83 HRH1 (0.98) HRH1CCR3KCNH2
SCHEMBL5190405 0.81 HRH1 (0.51) HRH1CCR3KCNH2
SCHEMBL4040955 0.81 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL4967102 0.80 HRH1 (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1816123-A1 Intermediates for the production of pharmaceutically active compounds AstraZeneca AB (SE) 2007-08-08 — — EP disclosed
EP-1546130-B1 PIPERIDINE DERIVATIVES FOR USE IN THE TREATMENT OF CHEMOKINE MEDIATED DISEASE STATES ASTRAZENECA AB (SE) 2007-08-01 — — EP disclosed
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