SCHEMBL7810522

SCHEMBL7810522

Cc1cc(C)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NCC4CCN(C=NN)CC4)c3Cl)c2n1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 18/20 0.69
BDKRB2 P30411 2/20 0.68

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 SCHEMBL7952866 0.99 RORC (0.68) RORCBDKRB2
SCHEMBL7818079 0.91 BDKRB2 (0.63) RORCBDKRB2
SCHEMBL7811022 0.90 BDKRB2 (0.70) RORCBDKRB2
Hydrochloric Acid SCHEMBL7956334 0.90 BDKRB2 (0.62) RORCBDKRB2
Hydrochloric Acid SCHEMBL7945814 0.90 BDKRB2 (0.69) RORCBDKRB2
SCHEMBL7810517 0.89 BDKRB2 (0.74) RORCBDKRB2
SCHEMBL7812555 0.89 RORC (0.67) RORCBDKRB2
Hydrochloric Acid SCHEMBL7952857 0.89 BDKRB2 (0.73) RORCBDKRB2
SCHEMBL7814668 0.88 BDKRB2 (0.61) RORCBDKRB2
SCHEMBL7815060 0.88 BDKRB2 (0.66) 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