SCHEMBL10074237

SCHEMBL10074237

COc1nc2c(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)CCc4ccc(C)cc4)c3Cl)cccc2n1Cc1ccccn1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 16/20 0.65

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
SCHEMBL658516 0.94 BDKRB2 (0.64) BDKRB2
SCHEMBL10072769 0.94 BDKRB2 (0.64) BDKRB2
SCHEMBL10072268 0.93 BDKRB2 (0.62) BDKRB2
SCHEMBL660112 0.93 BDKRB2 (0.62) BDKRB2
SCHEMBL10072767 0.91 BDKRB2 (0.64) BDKRB2
SCHEMBL661095 0.91 BDKRB2 (0.61) BDKRB2
SCHEMBL658324 0.91 BDKRB2 (0.70) BDKRB2
SCHEMBL10072762 0.91 BDKRB2 (0.61) BDKRB2
SCHEMBL657713 0.90 BDKRB2 (0.63) BDKRB2
SCHEMBL10072587 0.90 BDKRB2 (0.70) 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
WO-2012024419-A2 BRADYKININ RECEPTOR AGONISTS AND USES THEREOF TO TREAT OCULAR HYPERTENSION AND GLAUCOMA ALCON RESEARCH, LTD. (US) 2012-02-23 WO disclosed