SCHEMBL13639239

SCHEMBL13639239

CCc1cc(-c2nnc(S)n2-c2ccc(OC)c3ccccc23)c(OC)cc1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 2/20 0.36
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 4/20 0.35
LMNA P02545 3/20 0.35
GAA P10253 1/20 0.35
ATP4A P20648 2/20 0.34
ATP4B P51164 2/20 0.34
ATM Q13315 1/20 0.33
KDM4E B2RXH2 2/20 0.33
CNR2 P34972 1/20 0.33
ALOX15 P16050 2/20 0.33
HTT P42858 2/20 0.33
ALOX12 P18054 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL930136 0.95 MEN1 (0.36) MEN1KMT2AALDH1A1HPGDPOLB
SCHEMBL930607 0.89 L3MBTL1 (0.39) MEN1KMT2AALDH1A1HPGDPOLB
SCHEMBL14344425 0.82 GAA (0.42) MEN1KMT2AALDH1A1HPGDPOLB
SCHEMBL13099831 0.81 HSP90AA1 (0.35) MEN1KMT2AL3MBTL1MAPTLMNA
SCHEMBL977473 0.81 MEN1 (0.35) MEN1KMT2AALDH1A1HPGDPOLB
SCHEMBL14293305 0.80
SCHEMBL930886 0.79 MEN1 (0.33) MEN1KMT2AALDH1A1HPGDPOLB
SCHEMBL931450 0.78 ESR1 (0.36) MEN1KMT2AMAPTLMNAGAA
SCHEMBL788553 0.78 MEN1 (0.33) MEN1KMT2AALDH1A1HPGDPOLB
SCHEMBL2596705 0.78 MEN1 (0.33) MEN1KMT2AALDH1A1HPGDPOLB

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-1817295-B1 TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY SYNTA PHARMACEUTICALS CORP (US) 2012-11-07 EP disclosed