SCHEMBL3011027

SCHEMBL3011027

Cc1cc(-n2ccnc2)c2c(F)ccc(OCc3c(Cl)cncc3Cl)c2n1.Cc1cc(Cl)c2c(F)ccc(O)c2n1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 19/20 0.63
RORC P51449 1/20 0.39

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
SCHEMBL1564236 0.92 BDKRB2 (0.70) BDKRB2
SCHEMBL13145072 0.78 BDKRB2 (0.70) BDKRB2
SCHEMBL1563888 0.78 BDKRB2 (1.00) BDKRB2
SCHEMBL13145751 0.75 BDKRB2 (0.74) BDKRB2
SCHEMBL1565066 0.72 BDKRB2 (0.88) BDKRB2RORC
SCHEMBL1563198 0.71 BDKRB2 (0.84) BDKRB2RORC
SCHEMBL13145042 0.71 BDKRB2 (0.84) BDKRB2RORC
SCHEMBL2937315 0.71 MAPT (0.49)
SCHEMBL13145059 0.71 BDKRB2 (0.83) BDKRB2RORC
SCHEMBL1563002 0.70 BDKRB2 (0.79) BDKRB2RORC

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
EP-2144897-A1 8-OXY-QUINOLINE DERIVATIVES AS BRADYKININ B2 RECEPTOR MODULATORS Jerini AG (DE) 2010-01-20 EP disclosed
WO-2008116620-A1 8-OXY-QUINOLINE DERIVATIVES AS BRADYKININ B2 RECEPTOR MODULATORS JERINI AG (DE) 2008-10-02 WO disclosed