SCHEMBL7723149

SCHEMBL7723149

CC(Cc1cc(-c2nc3ccccc3s2)c(O)c(C(C)(C)C)c1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.45
HPGD P15428 1/20 0.43
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
TP53 P04637 3/20 0.42
RAB9A P51151 8/20 0.41
NPC1 O15118 6/20 0.41
RXFP1 Q9HBX9 1/20 0.41
KDM4E B2RXH2 5/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TNF P01375 1/20 0.41
NOD1 Q9Y239 1/20 0.41
ALDH1A1 P00352 1/20 0.40
GAA P10253 2/20 0.40
LMNA P02545 2/20 0.40
PTGES O14684 1/20 0.39
THRB P10828 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
APP P05067 1/20 0.39

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
SCHEMBL7723145 0.79 MAPT (0.47) MAPTHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL2774898 0.77 TNF (0.55) MAPTHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL1278385 0.74 HMGCR (0.54) MAPTHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL10769689 0.74 HMGCR (0.54) MAPTHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL132430 0.73 MAOB (0.39) MAPTHPGDMEN1KMT2ARAB9A
SCHEMBL6457663 0.73 L3MBTL1 (0.46) MAPTMEN1KMT2ASMN1; SMN2TP53
Methane SCHEMBL8586981 0.73 HMGCR (0.52) MAPTHPGDMEN1KMT2ASMN1; SMN2
Methane SCHEMBL5017099 0.73 HMGCR (0.52) MAPTHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL30672844 0.72 SENP7 (0.41) GAAL3MBTL1
SCHEMBL29269889 0.72 SENP7 (0.41) GAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263842-A2 HYPERBRANCHED AMPHIPHILIC POLYMERIC ADDITIVES AND POLYMER COMPOSITIONS WITH INCREASED SURFACE ENERGY Ciba SC Holding AG (CH) 2002-12-11 EP disclosed
WO-2001058987-A2 HYPERBRANCHED AMPHIPHILIC POLYMERIC ADDITIVES AND POLYMER COMPOSITIONS WITH INCREASED SURFACE ENERGY CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-08-16 WO disclosed