SCHEMBL8711089

SCHEMBL8711089

O=C(NC1CCN(Cc2ccccc2)C1)c1ccccc1-c1ccc(F)cc1

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 4/20 0.75
DRD2 P14416 10/20 0.75
DRD4 P21917 10/20 0.75
SIGMAR1 Q99720 3/20 0.62
SLC6A12 P48065 1/20 0.62
TMEM97 Q5BJF2 1/20 0.62
MCHR1 Q99705 1/20 0.62
HTR2A P28223 1/20 0.58
POLB P06746 1/20 0.56

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
SCHEMBL8706525 0.92 CCR3 (0.73) CCR3DRD2DRD4SIGMAR1POLB
SCHEMBL8706527 0.90 DRD4 (0.74) CCR3DRD2DRD4SLC6A12POLB
SCHEMBL8706275 0.90 DRD2 (0.65) CCR3DRD2DRD4SIGMAR1POLB
SCHEMBL8705987 0.89 CCR3 (0.75) CCR3DRD2DRD4SIGMAR1HTR2A
SCHEMBL8712704 0.88 DRD2 (0.76) CCR3DRD2DRD4SIGMAR1POLB
SCHEMBL18841068 0.86 CCR3 (1.00) CCR3MCHR1
SCHEMBL18841072 0.86 CCR3 (1.00) CCR3MCHR1
SCHEMBL8711087 0.86 DRD2 (1.00) CCR3DRD2DRD4SIGMAR1SLC6A12
SCHEMBL7239441 0.85 CCR3 (0.72) CCR3DRD4SIGMAR1SLC6A12TMEM97
SCHEMBL13580486 0.84 CCR3 (0.67) CCR3DRD4SIGMAR1SLC6A12TMEM97

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
WO-1998037064-A1 BENZAMIDES HAVING DOPAMINE D4 RECEPTOR AFFINITY HOECHST MARION ROUSSEL, INC. (US) 1998-08-27 WO disclosed