SCHEMBL7964147

SCHEMBL7964147

COCCOCOc1cc(C(O/N=C(\C(=O)O)c2csc(NC(c3ccccc3)(c3ccccc3)c3ccccc3)n2)C(=O)OC(c2ccccc2)c2ccccc2)cc(Cl)c1OCOCCOC

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.31
MAPT P10636 2/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL7964158 1.00 GAA (0.31) GAAMAPTLMNAMEN1HPGD
SCHEMBL7965978 0.93 LMNA (0.30) GAAMAPTLMNA
SCHEMBL7965969 0.93 LMNA (0.30) GAAMAPTLMNA
SCHEMBL7962990 0.91
SCHEMBL9361256 0.91 GAA (0.32) GAAMAPTLMNAMEN1KMT2A
SCHEMBL9361278 0.91 GAA (0.32) GAAMAPTLMNAMEN1KMT2A
SCHEMBL7966416 0.90 GAA (0.30) GAAMAPTLMNAMEN1HPGD
SCHEMBL7960651 0.89 GAA (0.30) GAAMAPTLMNAMEN1HPGD
SCHEMBL7960636 0.89 GAA (0.30) GAAMAPTLMNAMEN1HPGD
SCHEMBL7961028 0.83 LMNA (0.30) GAAMAPTLMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6313305-B1 ANTIBIOTICS, BACTERICIDES HOECHST MARION ROUSSEL (FR) 2001-11-06 US disclosed
US-5587372-A BACERICIDES ROUSSEL UCLAF (FR) 1996-12-24 US disclosed
US-5455238-A Bactericides ROUSSEL UCLAF (FR) 1995-10-03 US disclosed