SCHEMBL22563719

SCHEMBL22563719

COc1cc(C)c(S(=O)(=O)N(C)CCOCC(=O)NCCC(C)C)c(C)c1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BDKRB1 P46663 20/20 0.55

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
SCHEMBL22563721 0.90 BDKRB1 (0.52) BDKRB1
SCHEMBL3439879 0.84 BDKRB1 (0.59) BDKRB1
SCHEMBL700853 0.80 BDKRB1 (0.62) BDKRB1
SCHEMBL12317400 0.79 BDKRB1 (0.61) BDKRB1
SCHEMBL15347791 0.79 BDKRB1 (0.61) BDKRB1
SCHEMBL3439888 0.79 BDKRB1 (0.61) BDKRB1
SCHEMBL4128251 0.79 BDKRB1 (0.61) BDKRB1
SCHEMBL15355599 0.78 BDKRB1 (0.63) BDKRB1
SCHEMBL15347789 0.78 BDKRB1 (0.60) BDKRB1
SCHEMBL13936298 0.76 BDKRB1 (0.61) BDKRB1

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
EP-2895204-B1 COMPOSITIONS TARGETING BRADYKININ RECEPTOR B1 FOR MEDICAL IMAGING OF CANCER AND OTHER DISORDERS PROVINCIAL HEALTH SERVICES AUTHORITY (CA) 2020-10-21 — — EP disclosed
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