SCHEMBL31147816

SCHEMBL31147816

CCOC(=O)CCc1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
P2RY12 Q9H244 1/20 0.35
MAOB P27338 2/20 0.35
MAOA P21397 1/20 0.35
ADORA2A P29274 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 2/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL6107662 1.00 GAA (0.39) GAAPKMHTTKMT2ANPC1
SCHEMBL7525719 0.93 GAA (0.38) GAAPKMHTTKMT2AMAOB
SCHEMBL106255 0.92 GAA (0.36) GAAPKMHTTKMT2ANPC1
SCHEMBL105113 0.92 MAOB (0.35) GAAPKMHTTKMT2ANPC1
SCHEMBL9870753 0.91 CNR1 (0.40) GAAKMT2AMAOBMAOAKDM4E
SCHEMBL3288191 0.91 ALOX5 (0.36) GAAHTTKMT2ALMNAMAOB
SCHEMBL78795 0.90 GAA (0.42) GAAHTTKMT2ALMNAMAOB
SCHEMBL20819474 0.90 GAA (0.38) GAAPKMHTTKMT2ANPC1
SCHEMBL29664175 0.90 GAA (0.42) GAAHTTKMT2ALMNAMAOB
SCHEMBL9871781 0.90 GAA (0.34) GAAPKMHTTKMT2AMAOB

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-119156377-A UV light stabilizer 巴斯夫欧洲公司 2024-12-17 CN claimed
CN-118742541-A Ultraviolet light absorber 巴斯夫欧洲公司 2024-10-01 CN claimed
CN-119156377-A UV light stabilizer 巴斯夫欧洲公司 2024-12-17 CN disclosed
CN-118742541-A Ultraviolet light absorber 巴斯夫欧洲公司 2024-10-01 CN disclosed