SCHEMBL6952253

SCHEMBL6952253

Cc1cc(C)c2cccc(OCc3c(C)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NCCCNC(=O)c4ccc(/C(N)=N\O)cc4)c3C)c2n1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 5/20 0.72
RORC P51449 15/20 0.48

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
SCHEMBL6952256 1.00 BDKRB2 (0.72) BDKRB2RORC
SCHEMBL6951774 0.93 BDKRB2 (0.70) BDKRB2RORC
SCHEMBL6951771 0.93 BDKRB2 (0.70) BDKRB2RORC
SCHEMBL6946898 0.93 BDKRB2 (0.83) BDKRB2RORC
Hydrochloric Acid SCHEMBL8039009 0.92 BDKRB2 (0.82) BDKRB2RORC
SCHEMBL6946899 0.91 BDKRB2 (0.69) BDKRB2RORC
SCHEMBL6945318 0.91 BDKRB2 (0.69) BDKRB2RORC
Hydrochloric Acid SCHEMBL8039015 0.90 BDKRB2 (0.69) BDKRB2RORC
SCHEMBL6946404 0.87 BDKRB2 (0.82) BDKRB2RORC
SCHEMBL6946397 0.87 BDKRB2 (0.82) 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-0944618-B1 NOVEL N-BENZENESULPHONYL-L-PROLINE DERIVATIVES, METHOD FOR PREPARING AND THERAPEUTIC USE FOURNIER IND & SANTE (FR) 2003-09-24 EP disclosed
US-6063791-A N-benzenesulfonyl-L-proline derivatives, method for preparing and therapeutic use FOURNIER INDUSTRIE ET SANTE (FR) 2000-05-16 US disclosed