SCHEMBL8670958

SCHEMBL8670958

C=CCC(=O)NCC(=O)N(C)c1ccc(Cl)c(COc2cccn3cc(C)nc23)c1Cl

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 12/20 0.58

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
Hydrochloric Acid SCHEMBL8666026 0.99 BDKRB2 (0.59) BDKRB2
SCHEMBL8563093 0.90 BDKRB2 (0.61) BDKRB2
SCHEMBL8562463 0.85 BDKRB2 (0.81) BDKRB2
SCHEMBL8670748 0.84 BDKRB2 (0.56) BDKRB2
Hydrochloric Acid SCHEMBL8566487 0.84 BDKRB2 (0.82) BDKRB2
SCHEMBL8672832 0.84 BDKRB2 (0.74) BDKRB2
SCHEMBL8665539 0.84 BDKRB2 (0.74) BDKRB2
SCHEMBL8566181 0.84 BDKRB2 (0.55) BDKRB2
SCHEMBL8671026 0.84 BDKRB2 (0.63) BDKRB2
SCHEMBL8665859 0.83 BDKRB2 (0.67) 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