SCHEMBL4693286

SCHEMBL4693286

Cc1ccc(NC(=O)CCN2CC3CN(C(=O)c4ncccc4C)CC3C2)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.45
MALT1 Q9UDY8 1/20 0.45
DRD2 P14416 3/20 0.43
DRD4 P21917 3/20 0.43
DRD3 P35462 3/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 3/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
GRM1 Q13255 1/20 0.42
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL4689928 0.94 MALT1 (0.47) TP53MALT1DRD2DRD4DRD3
SCHEMBL4690539 0.88 TP53 (0.45) TP53MALT1DRD2DRD4DRD3
SCHEMBL4691527 0.87 DRD2 (0.47) TP53DRD2DRD4DRD3KMT2A
SCHEMBL4693056 0.87 TP53 (0.44) TP53MALT1KMT2ALMNAMAPT
SCHEMBL4690604 0.87 TP53 (0.44) TP53MALT1DRD2DRD4DRD3
SCHEMBL3281859 0.86 CCR5 (0.52) TP53KMT2ALMNAALDH1A1HPGD
SCHEMBL4693294 0.85 PDE10A (0.42) TP53MALT1LMNAMAPTALDH1A1
SCHEMBL4693136 0.85 MAPT (0.46) TP53MALT1KMT2ALMNAMAPT
SCHEMBL5662686 0.85 MALT1 (0.50) TP53MALT1DRD2DRD4DRD3
SCHEMBL4695194 0.85 TP53 (0.42) TP53MALT1DRD2DRD4DRD3

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