SCHEMBL7815218

SCHEMBL7815218

Cc1ccc2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)N(C)CCNC(=N)N)c3Cl)c2n1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 10/20 0.57
BDKRB2 P30411 10/20 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
Trifluoroacetic Acid SCHEMBL7954842 0.96 RORC (0.58) RORCBDKRB2
SCHEMBL7815049 0.90 RORC (0.55) RORCBDKRB2
SCHEMBL7815230 0.90 BDKRB2 (0.67) RORCBDKRB2
SCHEMBL7805390 0.90 RORC (0.62) RORCBDKRB2
SCHEMBL7815223 0.89 RORC (0.55) RORCBDKRB2
SCHEMBL7818085 0.89 BDKRB2 (0.71) RORCBDKRB2
SCHEMBL7812594 0.89 BDKRB2 (0.69) RORCBDKRB2
Hydrochloric Acid SCHEMBL7945807 0.88 BDKRB2 (0.68) RORCBDKRB2
Hydrochloric Acid SCHEMBL7956336 0.88 BDKRB2 (0.70) RORCBDKRB2
SCHEMBL7815661 0.87 RORC (0.61) RORCBDKRB2

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
EP-0874841-B1 1-BENZENESULFONYL PYRROLIDINE DERIVATIVES AS BRADYKININ RECEPTOR ANTAGONISTS FOURNIER IND & SANTE (FR) 2001-10-04 EP disclosed