SCHEMBL5215694

SCHEMBL5215694

Cc1nc(Cl)c(C=CC(=O)O)n1Cc1ccc(I)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 1/20 0.35
PTGFR P43088 1/20 0.35
PTGER3 P43115 1/20 0.35
PTGER2 P43116 1/20 0.35
PTGIR P43119 1/20 0.35
PTGDR Q13258 1/20 0.35
PPARG P37231 2/20 0.34
MAPT P10636 3/20 0.34
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ATM Q13315 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
APP P05067 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL5215687 1.00 TBXA2R (0.35) TBXA2RPTGFRPTGER3PTGER2PTGIR
SCHEMBL6185200 0.89 TBXA2R (0.46) TBXA2RPTGFRPTGER3PTGER2PTGIR
SCHEMBL6185207 0.89 TBXA2R (0.46) TBXA2RPTGFRPTGER3PTGER2PTGIR
SCHEMBL5216186 0.87 TBXA2R (0.36) TBXA2RPTGFRPTGER3PTGER2PTGIR
SCHEMBL5216178 0.87 TBXA2R (0.36) TBXA2RPTGFRPTGER3PTGER2PTGIR
SCHEMBL5673817 0.87 TBXA2R (0.35) TBXA2RPTGFRPTGER3PTGER2PTGIR
SCHEMBL5673821 0.87 TBXA2R (0.35) TBXA2RPTGFRPTGER3PTGER2PTGIR
SCHEMBL5673891 0.85 MAPT (0.38) TBXA2RPTGFRPTGER3PTGER2PTGIR
SCHEMBL5673807 0.85 HDAC1 (0.41) TBXA2RPTGFRPTGER3PTGER2PTGIR
SCHEMBL5673799 0.85 HDAC1 (0.41) TBXA2RPTGFRPTGER3PTGER2PTGIR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1142879-B1 IMIDAZOLE COMPOUNDS AND MEDICINAL USE THEREOF ASTELLAS PHARMA INC (JP) 2007-10-10 EP disclosed
US-7060721-B1 Imidazole compounds and medicinal use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2006-06-13 US disclosed
EP-1142879-A1 IMIDAZOLE COMPOUNDS AND MEDICINAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP disclosed