SCHEMBL7824203

SCHEMBL7824203

O=C(Nc1ccc(F)cc1)N1CCCCC1CN1CCC(Cc2ccc(F)cc2)CC1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 15/20 0.75
ALDH1A1 P00352 1/20 0.64
THRB P10828 1/20 0.49
ALOX12 P18054 1/20 0.49
KMT2A Q03164 1/20 0.49
EPHX2 P34913 1/20 0.47

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
SCHEMBL7829373 0.95 CCR3 (0.77) CCR3ALDH1A1
SCHEMBL7814938 0.90 CCR3 (0.62) CCR3ALDH1A1THRBALOX12KMT2A
SCHEMBL7813749 0.89 CCR3 (0.67) CCR3ALDH1A1KMT2A
SCHEMBL7825778 0.85 CCR3 (0.75) CCR3
SCHEMBL7827684 0.85 CCR3 (0.64) CCR3ALDH1A1
SCHEMBL7825296 0.83 CCR3 (0.75) CCR3
SCHEMBL7813020 0.80 CCR3 (0.57) CCR3ALDH1A1KMT2AEPHX2
SCHEMBL7825777 0.80 CCR3 (0.59) CCR3ALDH1A1
SCHEMBL7821497 0.80 CCR3 (0.57) CCR3ALDH1A1KMT2A
SCHEMBL7822342 0.80 CCR3 (0.54) CCR3THRBALOX12KMT2A

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