SCHEMBL6946178

SCHEMBL6946178

Cc1ccc2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NCCCNC(=O)c4ccc(/C(N)=N\O)cc4)c3Cl)c2n1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 10/20 0.72
RORC P51449 10/20 0.55
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
SCHEMBL6946182 1.00 BDKRB2 (0.72) BDKRB2RORCBDKRB1
SCHEMBL6947980 0.93 BDKRB2 (0.70) BDKRB2RORCBDKRB1
SCHEMBL6947983 0.93 BDKRB2 (0.70) BDKRB2RORCBDKRB1
SCHEMBL6952223 0.93 BDKRB2 (0.83) BDKRB2RORCBDKRB1
SCHEMBL7017837 0.92 BDKRB2 (0.71) BDKRB2RORC
SCHEMBL7017833 0.92 BDKRB2 (0.71) BDKRB2RORC
Hydrochloric Acid SCHEMBL8041983 0.92 BDKRB2 (0.82) BDKRB2RORCBDKRB1
SCHEMBL6952228 0.91 BDKRB2 (0.69) BDKRB2RORCBDKRB1
SCHEMBL6953812 0.91 BDKRB2 (0.69) BDKRB2RORCBDKRB1
Hydrochloric Acid SCHEMBL8041988 0.90 BDKRB2 (0.69) BDKRB2RORCBDKRB1

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