SCHEMBL30835554

SCHEMBL30835554

CCCCCC(=O)CC(=O)C(CC)CC

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 1/20 0.52
KMT2A Q03164 2/20 0.47
MAPT P10636 1/20 0.47
CES2 O00748 5/20 0.45
CES1 P23141 4/20 0.44
AKR1B1 P15121 1/20 0.43
MEN1 O00255 1/20 0.42
FAAH O00519 1/20 0.42
MAPK1 P28482 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
SCHEMBL16338750 0.94 CA2 (0.44) HAO1CES2CES1MAPK1
SCHEMBL25403873 0.85 TSHR (0.39) CES2CES1MAPK1
SCHEMBL31590747 0.81 HAO1 (0.53) HAO1KMT2AMAPTCES2CES1
SCHEMBL844234 0.80 CES2 (0.61) KMT2ACES2CES1MEN1
SCHEMBL26126508 0.80 CA2 (0.53) KMT2AMAPTMEN1MAPK1
Hydrochloric Acid SCHEMBL20399921 0.80 HAO1 (0.61) HAO1KMT2AMAPTCES2CES1
SCHEMBL250549 0.79 HAO1 (0.67) HAO1KMT2AMAPTCES2CES1
SCHEMBL2755036 0.79 HAO1 (0.57) HAO1KMT2AMAPTCES2CES1
SCHEMBL2139864 0.79 HAO1 (0.62) HAO1KMT2AMAPTCES2CES1
SCHEMBL12344752 0.79 HAO1 (0.57) HAO1KMT2AMAPTCES2CES1

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-117897439-A Method for screening solvent for extraction of polyvinyl chloride, method for recovering waste material, and recovered polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN claimed
CN-117897440-A Method for screening solvent for extraction of polyvinyl chloride, method for recycling waste material, recycled polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN claimed
CN-117897439-A Method for screening solvent for extraction of polyvinyl chloride, method for recovering waste material, and recovered polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN disclosed
CN-117897440-A Method for screening solvent for extraction of polyvinyl chloride, method for recycling waste material, recycled polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN disclosed