SCHEMBL7814938

SCHEMBL7814938

O=C(Nc1ccc(F)cc1)N1CCCCC1CCN1CCC(Cc2ccc(F)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 14/20 0.62
ALDH1A1 P00352 1/20 0.61
CCR2 P41597 1/20 0.49
THRB P10828 1/20 0.47
ALOX12 P18054 1/20 0.47
KMT2A Q03164 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
SCHEMBL7827684 0.95 CCR3 (0.64) CCR3ALDH1A1
SCHEMBL7821497 0.90 CCR3 (0.57) CCR3ALDH1A1CCR2KMT2A
SCHEMBL7824203 0.90 CCR3 (0.75) CCR3ALDH1A1THRBALOX12KMT2A
SCHEMBL7815115 0.87 CCR3 (0.84) CCR3
SCHEMBL7821639 0.86 CCR3 (0.65) CCR3
SCHEMBL7829373 0.85 CCR3 (0.77) CCR3ALDH1A1
SCHEMBL7813828 0.83 CCR3 (0.64) CCR3ALDH1A1
SCHEMBL7825484 0.81 CCR3 (0.50) CCR3
SCHEMBL7829620 0.80 CCR3 (0.75) CCR3
SCHEMBL7813749 0.80 CCR3 (0.67) CCR3ALDH1A1KMT2A

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