SCHEMBL7811244

SCHEMBL7811244

Cc1ccc2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NC4CCN(C(=O)OC(C)(C)C)CC4)c3Cl)c2n1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RORC P51449 13/20 0.60
BDKRB2 P30411 7/20 0.57
BDKRB1 P46663 1/20 0.52

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
SCHEMBL7805204 0.92 BDKRB2 (0.63) RORCBDKRB2BDKRB1
SCHEMBL7814262 0.91 RORC (0.58) RORCBDKRB2
SCHEMBL7818596 0.91 RORC (0.58) RORCBDKRB2BDKRB1
SCHEMBL7812394 0.90 RORC (0.67) RORCBDKRB2
SCHEMBL7814911 0.90 RORC (0.55) RORCBDKRB2BDKRB1
SCHEMBL7814482 0.90 BDKRB2 (0.63) RORCBDKRB2BDKRB1
SCHEMBL7814516 0.90 RORC (0.59) RORCBDKRB2BDKRB1
SCHEMBL7805278 0.90 RORC (0.55) RORCBDKRB2BDKRB1
SCHEMBL7805277 0.90 RORC (0.55) RORCBDKRB2BDKRB1
Hydrochloric Acid SCHEMBL7945816 0.90 RORC (0.58) RORCBDKRB2BDKRB1

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-0874841-B1 1-BENZENESULFONYL PYRROLIDINE DERIVATIVES AS BRADYKININ RECEPTOR ANTAGONISTS FOURNIER IND & SANTE (FR) 2001-10-04 EP disclosed
US-6211181-B1 ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIALLERGENS, AND ANTIASTHMATICS FOURNIER INDUSTRIE ET SANTE (FR) 2001-04-03 US disclosed