SCHEMBL7811570

SCHEMBL7811570

Cc1cc(C)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NCc4ccc(C(=N)N)cc4)c3Cl)c2n1

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 3/20 0.84
RORC P51449 17/20 0.66

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
SCHEMBL8181611 0.99 BDKRB2 (0.82) BDKRB2RORC
SCHEMBL7819021 0.94 BDKRB2 (0.85) BDKRB2RORC
SCHEMBL7811444 0.94 BDKRB2 (0.79) BDKRB2RORC
Hydrochloric Acid SCHEMBL8187928 0.94 BDKRB2 (0.84) BDKRB2RORC
Hydrochloric Acid SCHEMBL8187359 0.94 BDKRB2 (0.78) BDKRB2RORC
SCHEMBL7815210 0.94 BDKRB2 (0.74) BDKRB2RORC
SCHEMBL6952937 0.94 BDKRB2 (0.84) BDKRB2RORC
SCHEMBL7815008 0.93 BDKRB2 (0.88) BDKRB2RORC
SCHEMBL7805651 0.93 BDKRB2 (0.75) BDKRB2RORC
Hydrochloric Acid SCHEMBL8038443 0.93 BDKRB2 (0.83) 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-0925295-B1 N-BENZENESULPHONYL-L-PROLINE DERIVATIVES AS B2 RECEPTOR ANTAGONISTS OF THE BRADYKININ FOURNIER IND & SANTE (FR) 2001-10-04 EP disclosed
US-6071917-A ANALGESICS; ANTIINFLAMMATORY AGENTS; ESPECIALLY FOR THE TREATMENT OF ASTHMA, CEREBRAL TRAUMATIC SHOCK AND ALLERGIC RHINITIS; COMPETITIVE BINDING AT RECEPTORS FOURNIER INDUSTRIE ET SANTE (FR) 2000-06-06 US disclosed