SCHEMBL8668433

SCHEMBL8668433

Cc1cn2cccc(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)Nc4ccc(C(F)(F)F)cc4)c3Cl)c2n1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 18/20 0.64

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 SCHEMBL8671465 0.99 BDKRB2 (0.64) BDKRB2
SCHEMBL8665859 0.93 BDKRB2 (0.67) BDKRB2
SCHEMBL8666028 0.92 BDKRB2 (0.63) BDKRB2
Hydrochloric Acid SCHEMBL8668393 0.92 BDKRB2 (0.67) BDKRB2
SCHEMBL8665539 0.92 BDKRB2 (0.74) BDKRB2
Hydrochloric Acid SCHEMBL8671268 0.92 BDKRB2 (0.63) BDKRB2
Hydrochloric Acid SCHEMBL8669770 0.91 BDKRB2 (0.74) BDKRB2
SCHEMBL8669018 0.91 BDKRB2 (0.65) BDKRB2
Hydrochloric Acid SCHEMBL8665438 0.91 BDKRB2 (0.66) BDKRB2
SCHEMBL8667838 0.90 BDKRB2 (0.65) 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