SCHEMBL5300097

SCHEMBL5300097

Nc1cc(Cl)c(Cl)cc1Cn1cnnc1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.39
CCR2 P41597 1/20 0.39
CCR4 P51679 1/20 0.39
GAA P10253 1/20 0.36
CYP19A1 P11511 3/20 0.34
CD44 P16070 1/20 0.30
FLT1 P17948 1/20 0.30
AHR P35869 1/20 0.30

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
SCHEMBL14610754 0.72 CYP19A1 (0.46) CCR1CCR2CCR4CYP19A1
SCHEMBL14610530 0.72 CCR1 (0.49) CCR1CCR2CCR4CYP19A1
SCHEMBL14610826 0.70 CCR1 (0.40) CCR1CCR2CCR4
SCHEMBL27895858 0.68 GAA (0.48) GAACD44FLT1AHR
SCHEMBL5306461 0.67 SMN1; SMN2 (0.56) CCR1CCR2CCR4CYP19A1
SCHEMBL16181881 0.66 GAA (0.46) GAACD44FLT1AHR
SCHEMBL12963082 0.66 GAA (0.46) GAACD44
SCHEMBL28962613 0.63 HTT (0.57) GAA
SCHEMBL30216869 0.63 HTT (0.57) GAA
SCHEMBL14322800 0.63 CYP11B1 (0.60) CYP19A1

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
WO-2007014054-A2 BENZENESULFONAMIDE INHIBITOR OF CCR2 CHEMOKINE RECEPTOR GLAXO GROUP LIMTED (GB) 2007-02-01 WO disclosed
WO-2007014054-A2 BENZENESULFONAMIDE INHIBITOR OF CCR2 CHEMOKINE RECEPTOR GLAXO GROUP LIMTED (GB) 2007-02-01 WO disclosed