SCHEMBL4694306

SCHEMBL4694306

Cc1ccc(NCCCN2CC3CN(S(=O)(=O)c4c(C)nn(C)c4C)CC3C2)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 19/20 0.56
PROKR1 Q8TCW9 19/20 0.56

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
SCHEMBL4696048 0.92 FPR2 (0.48) FPR2PROKR1
SCHEMBL4692449 0.85 ALDH1A1 (0.46)
SCHEMBL4695297 0.84 LMNA (0.50)
SCHEMBL4694302 0.83 MAPT (0.55) FPR2PROKR1
SCHEMBL4694268 0.82 POLB (0.45) FPR2PROKR1
SCHEMBL3283683 0.81 MAPT (0.47)
SCHEMBL13326676 0.80 ALDH1A1 (0.41)
SCHEMBL3283552 0.78 CCR1 (0.42)
SCHEMBL4693295 0.78 ALDH1A1 (0.48)
SCHEMBL4690883 0.77 NR1H4 (0.41)

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-1761542-B1 OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS HOFFMANN LA ROCHE (CH) 2008-01-02 EP claimed
EP-1761542-A2 OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2007-03-14 EP claimed
WO-2005121145-A2 OCTAHYDRO-PYRROLO[3,4-C] DERIVATIVES AND THEIR USE AS ANTIVIRAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2005-12-22 WO claimed
EP-1761542-B1 OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS HOFFMANN LA ROCHE (CH) 2008-01-02 EP disclosed