SCHEMBL1816342

SCHEMBL1816342

CCOC(=O)C(=O)CC(=O)COC.CCOC(=O)c1cc(COC)n[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.43
MAPT P10636 6/20 0.43
NPC1 O15118 5/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALPL P05186 3/20 0.41
KMT2A Q03164 3/20 0.40
HPGDS O60760 2/20 0.40
ACR P10323 1/20 0.39
TP53 P04637 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
MAPK1 P28482 1/20 0.36
PDE4D Q08499 1/20 0.36
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36

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
SCHEMBL1817376 0.86 RAB9A (0.53) RAB9AMAPTNPC1L3MBTL1ALPL
SCHEMBL1806737 0.75 GAA (0.39) RAB9AMAPTKDM4EALDH1A1LMNA
SCHEMBL1430763 0.74 ALPL (0.55) RAB9AMAPTNPC1L3MBTL1ALPL
SCHEMBL16763424 0.74 ALPL (0.55) RAB9AMAPTNPC1L3MBTL1ALPL
SCHEMBL1456739 0.72 ALPL (0.54) RAB9AMAPTNPC1L3MBTL1ALPL
SCHEMBL23500795 0.71 ALPL (0.56) RAB9AMAPTNPC1L3MBTL1ALPL
SCHEMBL1359 0.71 ALPL (0.52) RAB9AMAPTNPC1L3MBTL1ALPL
SCHEMBL9900502 0.69 HPGDS (0.58) RAB9AMAPTNPC1L3MBTL1ALPL
SCHEMBL1815529 0.69 HCAR2 (0.53) ALPLTP53MAPK1
SCHEMBL7008825 0.69 ALPL (0.50) RAB9AMAPTNPC1L3MBTL1ALPL

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-2493858-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS Orion Corporation (FI) 2012-09-05 EP disclosed
WO-2011051540-A9 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORPORATION (FI) 2012-06-21 WO disclosed
WO-2011051540-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORPORATION (FI) 2011-05-05 WO disclosed