SCHEMBL7653976

SCHEMBL7653976

CCCN1CC[C@H](Cc2ccc(F)cc2)C[C@H]1CCCNC(=O)Nc1cccc(C(C)=O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 20/20 1.00
SLC6A2 P23975 15/20 1.00
SLC6A4 P31645 15/20 1.00
SLC6A3 Q01959 15/20 1.00
HTR2A P28223 1/20 0.71

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
SCHEMBL7653971 1.00 CCR3 (1.00) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL7659147 1.00 CCR3 (1.00) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL7658779 1.00 CCR3 (1.00) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL7662809 0.94 CCR3 (1.00) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL6773194 0.94 CCR3 (1.00) CCR3SLC6A2SLC6A4SLC6A3
SCHEMBL18840948 0.94 CCR3 (1.00) CCR3SLC6A2SLC6A4SLC6A3
SCHEMBL7667502 0.93 CCR3 (0.89) CCR3SLC6A2SLC6A4SLC6A3
SCHEMBL7667508 0.93 CCR3 (0.89) CCR3SLC6A2SLC6A4SLC6A3
SCHEMBL6773307 0.91 CCR3 (1.00) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL26079496 0.91 CCR3 (0.91) CCR3SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6441001-B1 2-substituted-4-nitrogen heterocycles as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-08-27 US claimed