SCHEMBL28429112

SCHEMBL28429112

CC(C)(C)c1cc(CCC(=O)N(CCN)C(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.58
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.46
ALDH1A1 P00352 5/20 0.45
LMNA P02545 4/20 0.45
TSHR P16473 3/20 0.45
MAPK1 P28482 3/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
BLM P54132 2/20 0.42
ATM Q13315 2/20 0.42
HIF1A Q16665 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
USP2 O75604 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
SCHEMBL2050512 0.93 GAA (0.55) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL351986 0.91 GAA (0.52) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL21797772 0.90 GAA (0.56) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL28594905 0.85 GAA (0.46) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL501541 0.84 GAA (0.65) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL28728253 0.84 GAA (0.48) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL11326707 0.81 GAA (0.60) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL13917314 0.79 ALDH1A1 (0.55) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL27920801 0.79 GAA (0.58) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL9064772 0.79 GAA (0.57) GAAKMT2AMEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117603578-A Glass fiber reinforced nylon material with high mechanical property and meeting optical design of computer keyboard and preparation method thereof 安特普工程塑料(苏州)有限公司 2024-02-27 CN claimed
CN-111333971-A PS gasket and preparation method thereof 浙江锦浩光电材料有限公司 2020-06-26 CN claimed
CN-117603578-A Glass fiber reinforced nylon material with high mechanical property and meeting optical design of computer keyboard and preparation method thereof 安特普工程塑料(苏州)有限公司 2024-02-27 CN disclosed
CN-111333971-A PS gasket and preparation method thereof 浙江锦浩光电材料有限公司 2020-06-26 CN disclosed