Sugi Predict

Sugi Predict / Compounds / SCHEMBL6152263

SCHEMBL6152263

SCHEMBL6152263

CCNCCOCc1ccccc1CCC1=C(C(=O)O)C(c2c(Cl)cccc2Cl)C(C(=O)O)=C(CC(=O)N2CCN(C3CC4CCC(C3)N4C)CC2)N1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCR3 P51677 1/20 0.32
▸ BDKRB1 P46663 1/20 0.31

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
SCHEMBL6152440 0.94 PTAFR (0.33) CCR3BDKRB1
SCHEMBL6152832 0.91 CCR3 (0.33) CCR3BDKRB1
SCHEMBL6152716 0.91 CCR3 (0.33) CCR3BDKRB1
SCHEMBL6152456 0.90 BDKRB1 (0.35) CCR3BDKRB1
SCHEMBL6153216 0.89 CCR3 (0.32) CCR3BDKRB1
SCHEMBL6152003 0.89 CCR3 (0.31) CCR3BDKRB1
SCHEMBL6152510 0.88 POLB (0.33) CCR3BDKRB1
SCHEMBL6152315 0.87 BDKRB1 (0.35) BDKRB1
Succinic Acid SCHEMBL6152801 0.87 CCR3 (0.31) CCR3BDKRB1
SCHEMBL6152408 0.86 CCR3 (0.36) CCR3BDKRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1307449-B1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMA (JP) 2005-12-07 — — EP disclosed
EP-1307449-A1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMACEUTICALS INC. (JP) 2003-05-07 — — EP disclosed
WO-2002012235-A1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMACEUTICALS INC. (JP) 2002-02-14 — — WO disclosed