SCHEMBL7010679

SCHEMBL7010679

Cc1nc2c(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)N4CCN(C(=O)c5ccc(C(=N)N)cc5)CC4)c3Cl)cccn2c1Br

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 2/20 0.51
RORC P51449 3/20 0.51

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
SCHEMBL7010675 1.00 BDKRB2 (0.51) BDKRB2RORC
Hydrochloric Acid SCHEMBL7722630 0.99 BDKRB2 (0.51) BDKRB2RORC
Hydrochloric Acid SCHEMBL7722632 0.99 BDKRB2 (0.51) BDKRB2RORC
SCHEMBL7007117 0.94 BDKRB2 (0.52) BDKRB2RORC
SCHEMBL7007118 0.94 BDKRB2 (0.52) BDKRB2RORC
Hydrochloric Acid SCHEMBL7719780 0.93 BDKRB2 (0.52) BDKRB2RORC
Hydrochloric Acid SCHEMBL7719778 0.93 BDKRB2 (0.52) BDKRB2RORC
SCHEMBL7010687 0.91 RORC (0.48) BDKRB2RORC
Hydrochloric Acid SCHEMBL7722636 0.90 RORC (0.48) BDKRB2RORC
SCHEMBL7012584 0.89 BDKRB2 (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0991650-B1 NOVEL N-BENZENESULPHONYL-L-PROLINE COMPOUNDS, PREPARATION METHOD AND USE IN THERAPY FOURNIER IND & SANTE (FR) 2003-09-10 EP disclosed