SCHEMBL13809337

SCHEMBL13809337

Cc1ccc(NC2CCN(S(=O)(=O)c3ccccc3)CC2)c(CO)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
MEN1 O00255 6/20 0.52
KMT2A Q03164 6/20 0.52
PKM P14618 2/20 0.47
CCR6 P51684 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
PLA2G1B P04054 1/20 0.45
ATG4B Q9Y4P1 1/20 0.45

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
SCHEMBL13592119 0.89 LMNA (0.54) ALDH1A1MEN1KMT2APKMLMNA
SCHEMBL14093631 0.87 KMT2A (0.48) ALDH1A1MEN1KMT2APKMCCR6
SCHEMBL14093356 0.79 KMT2A (0.51) ALDH1A1MEN1KMT2APKMLMNA
SCHEMBL13592187 0.77 PKM (0.52) ALDH1A1MEN1KMT2APKMCCR6
SCHEMBL13592095 0.77 POLB (0.57) ALDH1A1MEN1KMT2APKML3MBTL1
SCHEMBL13809326 0.77 PKM (0.57) ALDH1A1MEN1KMT2APKMCCR6
SCHEMBL13592106 0.77 PKM (0.57) ALDH1A1MEN1KMT2APKMCCR6
SCHEMBL13592100 0.76 CNR1 (0.54) ALDH1A1MEN1KMT2APKMLMNA
SCHEMBL14093622 0.76 PKM (0.53) ALDH1A1KMT2APKMCCR6
SCHEMBL13809460 0.76 PKM (0.50) ALDH1A1MEN1KMT2APKMCCR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1660131-B1 ACTIVE SUBSTANCE COMBINATION COMPRISING A COMPOUND WITH NPY RECEPTOR AFFINITY AND A COMPOUND WITH 5-HT6 RECEPTOR AFFINITY ESTEVE LABOR DR (ES) 2009-06-24 EP disclosed