SCHEMBL7822009

SCHEMBL7822009

CCOC(=O)c1cccc(NC(=O)N2CCCC(CN3CCC(Cc4ccc(F)cc4)CC3)C2)c1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 18/20 0.75
MAPT P10636 1/20 0.64
CYP2D6 P10635 1/20 0.51

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
SCHEMBL7823114 0.96 CCR3 (0.74) CCR3MAPT
SCHEMBL7829336 0.93 CCR3 (0.76) CCR3MAPTCYP2D6
SCHEMBL7824997 0.93 CCR3 (0.73) CCR3MAPT
SCHEMBL7825455 0.87 CCR3 (0.76) CCR3MAPT
SCHEMBL5359311 0.86 CCR3 (0.73) CCR3CYP2D6
SCHEMBL7821529 0.86 CCR3 (0.66) CCR3MAPT
SCHEMBL7829333 0.85 CCR3 (0.56) CCR3MAPTCYP2D6
SCHEMBL7825296 0.84 CCR3 (0.75) CCR3MAPT
SCHEMBL7814197 0.84 CCR3 (0.77) CCR3
SCHEMBL5367460 0.83 CCR3 (0.69) CCR3CYP2D6

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-1140834-A1 HETEROCYCLIC PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Du Pont Pharmaceuticals Company (US) 2001-10-10 EP disclosed
WO-2000035877-A1 HETEROCYCLIC PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARMACEUTICALS COMPANY (US) 2000-06-22 WO disclosed