Sugi Predict

Sugi Predict / Compounds / SCHEMBL6950095

SCHEMBL6950095

SCHEMBL6950095

Cc1cc(C(F)(F)F)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NCCCNC(=O)c4ccc(/C(N)=N\O)cc4)c3Cl)c2n1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BDKRB2 P30411 2/20 0.76
▸ RORC P51449 18/20 0.72

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
SCHEMBL6950098 1.00 BDKRB2 (0.76) BDKRB2RORC
SCHEMBL6953653 0.94 BDKRB2 (0.73) BDKRB2RORC
SCHEMBL6953657 0.94 BDKRB2 (0.73) BDKRB2RORC
SCHEMBL6951712 0.93 BDKRB2 (0.87) BDKRB2RORC
SCHEMBL8028473 0.92 BDKRB2 (0.85) BDKRB2RORC
SCHEMBL6951715 0.92 BDKRB2 (0.73) BDKRB2RORC
SCHEMBL8028477 0.91 BDKRB2 (0.72) BDKRB2RORC
SCHEMBL7017837 0.90 BDKRB2 (0.71) BDKRB2RORC
SCHEMBL7017833 0.90 BDKRB2 (0.71) BDKRB2RORC
SCHEMBL6946404 0.89 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