SCHEMBL3633570

SCHEMBL3633570

C=CCOc1c(Cl)cccc1C(=O)NC1(C(=O)OC(=O)C2(NC(=O)c3cccc(Cl)c3OC(C)C)Cc3ccccc3C2)Cc2ccccc2C1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CXCR5 P32302 20/20 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
SCHEMBL3633568 0.92 CXCR5 (0.85) CXCR5
SCHEMBL3304519 0.85 CXCR5 (0.76) CXCR5
SCHEMBL3312934 0.83 CXCR5 (1.00) CXCR5
SCHEMBL3309007 0.83 CXCR5 (0.61) CXCR5
SCHEMBL3306765 0.81 CXCR5 (0.78) CXCR5
SCHEMBL3309706 0.75 CXCR5 (0.79) CXCR5
SCHEMBL3309731 0.74 CXCR5 (1.00) CXCR5
SCHEMBL3306951 0.73 CXCR5 (0.77) CXCR5
SCHEMBL3304472 0.70 CXCR5 (1.00) CXCR5
SCHEMBL13328299 0.70 CXCR5 (0.70) CXCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2155711-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS Sanofi-Aventis (FR) 2010-02-24 EP claimed
WO-2008151211-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS SANOFI-AVENTIS (FR) 2008-12-11 WO claimed
EP-2155711-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS Sanofi-Aventis (FR) 2010-02-24 EP disclosed
WO-2008151211-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS SANOFI-AVENTIS (FR) 2008-12-11 WO disclosed