Sugi Predict

Sugi Predict / Compounds / SCHEMBL7814517

SCHEMBL7814517

SCHEMBL7814517

Cc1cc(C)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NCCN/C(=N\C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)c3Cl)c2n1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BDKRB2 P30411 2/20 0.67
▸ RORC P51449 18/20 0.63

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
SCHEMBL7812379 0.98 BDKRB2 (0.71) BDKRB2RORC
SCHEMBL7812381 0.98 BDKRB2 (0.71) BDKRB2RORC
SCHEMBL7818231 0.91 RORC (0.57) BDKRB2RORC
SCHEMBL7814455 0.91 BDKRB2 (0.57) BDKRB2RORC
SCHEMBL7959602 0.90 BDKRB2 (0.77) BDKRB2RORC
SCHEMBL6953002 0.90 BDKRB2 (0.74) BDKRB2RORC
SCHEMBL7815353 0.89 BDKRB2 (0.61) BDKRB2RORC
SCHEMBL7815349 0.89 BDKRB2 (0.61) BDKRB2RORC
SCHEMBL7945796 0.89 BDKRB2 (0.57) BDKRB2RORC
SCHEMBL7811148 0.89 BDKRB2 (0.58) 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-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