SCHEMBL6946877

SCHEMBL6946877

Cc1cc(C)c2cccc(OCc3c(C)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)O)c3C)c2n1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 17/20 0.65
BDKRB2 P30411 3/20 0.55

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
SCHEMBL8045401 0.92 RORC (0.56) RORCBDKRB2
SCHEMBL3743960 0.88 RORC (0.83) RORCBDKRB2
SCHEMBL6946090 0.88 RORC (0.83) RORCBDKRB2
SCHEMBL8189405 0.87 RORC (0.62) RORCBDKRB2
SCHEMBL8181772 0.86 RORC (0.71) RORCBDKRB2
SCHEMBL6946898 0.82 BDKRB2 (0.83) RORCBDKRB2
SCHEMBL6945318 0.81 BDKRB2 (0.69) RORCBDKRB2
Hydrochloric Acid SCHEMBL8039009 0.81 BDKRB2 (0.82) RORCBDKRB2
SCHEMBL6952256 0.81 BDKRB2 (0.72) RORCBDKRB2
SCHEMBL6952253 0.81 BDKRB2 (0.72) RORCBDKRB2

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 4 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
EP-0944618-A1 NOVEL N-BENZENESULPHONYL-L-PROLINE DERIVATIVES, METHOD FOR PREPARING AND THERAPEUTIC USE FOURNIER INDUSTRIE ET SANTE (FR) 1999-09-29 EP disclosed
WO-1998024783-A1 NOVEL N-BENZENESULPHONYL-L-PROLINE DERIVATIVES, METHOD FOR PREPARING AND THERAPEUTIC USE FOURNIER INDUSTRIE ET SANTE (FR) 1998-06-11 WO disclosed