SCHEMBL30002767

SCHEMBL30002767

CCc1cc(CC)cc(OB(O)O)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.37
LIPG Q9Y5X9 1/20 0.37
PTGS2 P35354 1/20 0.35
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
TRPA1 O75762 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31

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
SCHEMBL7582199 0.79 MAPK1 (0.44) CYP1A2CYP2A6
SCHEMBL2126535 0.77 LPL (0.52) LPLLIPGRXRARXRBCYP2A6
SCHEMBL27720740 0.77
SCHEMBL28070668 0.77 ST14 (0.35)
SCHEMBL29172593 0.76 PTGS2 (0.39) LPLLIPGPTGS2RXRARXRB
SCHEMBL28164833 0.76 ST14 (0.34)
SCHEMBL4578633 0.74 ALDH1A1 (0.32)
SCHEMBL27926932 0.72 ALDH1A1 (0.31)
SCHEMBL7851797 0.72 LPL (0.47) LPLLIPGRXRARXRB
SCHEMBL9487275 0.72 PTGS2 (0.42) PTGS2RXRARXRBTRPA1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115380099-A Organic light emitting compound and organic light emitting device including the same 株式会社P&H TECH 2022-11-22 CN disclosed