SCHEMBL8724025

SCHEMBL8724025

CC(=O)Nc1[nH]cc(C)c1-c1ccc(Cl)c(COc2cccc3c(-n4ccnc4)cc(C)nc23)c1Cl

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 15/20 0.58
RORC P51449 5/20 0.57

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
SCHEMBL8724045 0.88 BDKRB2 (0.57) BDKRB2RORC
SCHEMBL7007131 0.82 BDKRB2 (0.61) BDKRB2RORC
SCHEMBL8554602 0.82 BDKRB2 (0.55) BDKRB2RORC
SCHEMBL8719597 0.81 BDKRB2 (0.55) BDKRB2RORC
Hydrochloric Acid SCHEMBL6958840 0.78 BDKRB2 (0.69) BDKRB2RORC
SCHEMBL6974081 0.78 BDKRB2 (0.78) BDKRB2RORC
SCHEMBL6971663 0.78 BDKRB2 (0.69) BDKRB2RORC
SCHEMBL7007129 0.78 BDKRB2 (0.73) BDKRB2RORC
SCHEMBL13145764 0.77 BDKRB2 (0.66) BDKRB2RORC
SCHEMBL13145024 0.76 BDKRB2 (0.67) 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-0861243-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-02 EP disclosed
WO-1997011069-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-27 WO disclosed