SCHEMBL8665873

SCHEMBL8665873

Cc1cn2cccc(OCc3c(Cl)ccc(N(C)C(=O)NC(=O)C(Cl)(Cl)Cl)c3Cl)c2n1

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 3/20 0.50

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
SCHEMBL8568084 0.86 BDKRB2 (0.54) BDKRB2
SCHEMBL8569323 0.86 BDKRB2 (0.56) BDKRB2
Hydrochloric Acid SCHEMBL8672888 0.85 BDKRB2 (0.56) BDKRB2
SCHEMBL8564939 0.84 BDKRB2 (0.51) BDKRB2
SCHEMBL8670748 0.84 BDKRB2 (0.56) BDKRB2
SCHEMBL8562547 0.84 BDKRB2 (0.50) BDKRB2
SCHEMBL8567583 0.84 BDKRB2 (0.72) BDKRB2
SCHEMBL8566181 0.84 BDKRB2 (0.55) BDKRB2
SCHEMBL8667352 0.82 BDKRB2 (0.50) BDKRB2
SCHEMBL8566861 0.82 BDKRB2 (0.48) BDKRB2

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
US-5750699-A HALOGENATING OF CORRESPONDING COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed