SCHEMBL6156025

SCHEMBL6156025

Cc1c(O)ccc2c(NC(=O)CN(C)C)cc(=O)oc12

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.55
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 1/20 0.53
GLA P06280 1/20 0.53
HPGD P15428 1/20 0.53
CA12 O43570 8/20 0.48
CA9 Q16790 8/20 0.48
TNF P01375 1/20 0.48
NOD2 Q9HC29 1/20 0.48
NOD1 Q9Y239 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 1/20 0.44
MAOA P21397 1/20 0.44

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
SCHEMBL5345045 0.73 MAOB (0.77) MAOBKDM4EALDH1A1GLAHPGD
SCHEMBL6159090 0.73 MAOB (0.67) MAOBKDM4EALDH1A1GLAHPGD
SCHEMBL4187220 0.72 MAOB (1.00) MAOBKDM4EALDH1A1GLAHPGD
SCHEMBL6155496 0.70 MAOB (0.73) MAOBKDM4EALDH1A1GLAHPGD
SCHEMBL31139188 0.70 MAOB (0.73) MAOBKDM4EALDH1A1GLAHPGD
SCHEMBL3433162 0.69 MAOB (0.74) MAOBKDM4EALDH1A1GLAHPGD
SCHEMBL876286 0.69 MCL1 (0.73) MAOBKDM4EALDH1A1GLAHPGD
SCHEMBL15984890 0.68 KDM4E (0.64) MAOBKDM4EALDH1A1GLAHPGD
SCHEMBL22840392 0.67 MAOB (0.67) MAOBKDM4EALDH1A1GLAHPGD
SCHEMBL12938630 0.67 TERT (0.47) KDM4EALDH1A1HPGDMEN1KMT2A

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
EP-0894805-B1 Ribose substituted aromatic derivatives, their preparation and use as medicaments AVENTIS PHARMA SA (FR) 2005-02-09 EP disclosed
US-5968939-A ANTIBIOTICS FROM AMINOOXOBENZOPYRAN COMPOUNDS HOECHST MARION ROUSSEL (FR) 1999-10-19 US disclosed
EP-0894805-A1 Ribose substituted aromatic derivatives, their preparation and use as medicaments HOECHST MARION ROUSSEL (FR) 1999-02-03 EP disclosed