SCHEMBL18924158

SCHEMBL18924158

CCCCCC(CC)OC1OC(CO)C(O)C(O)C1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.45
CETP P11597 1/20 0.45
SYNJ2 O15056 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ABL1 P00519 1/20 0.44
ALPL P05186 1/20 0.44
POLB P06746 1/20 0.44
ALPI P09923 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
ALPG P10696 1/20 0.44
PABPC1 P11940 1/20 0.44
RECQL P46063 1/20 0.44
GALK1 P51570 1/20 0.44
CASP7 P55210 1/20 0.44
CASP6 P55212 1/20 0.44
MCL1 Q07820 1/20 0.44
RIN1 Q13671 1/20 0.44
EIF4H Q15056 1/20 0.44
PPARG P37231 1/20 0.44

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
SCHEMBL332798 1.00 AKT1 (0.45) AKT1CETPSYNJ2KDM4EABL1
SCHEMBL17792462 1.00 AKT1 (0.45) AKT1CETPSYNJ2KDM4EABL1
SCHEMBL13362442 1.00 AKT1 (0.45) AKT1CETPSYNJ2KDM4EABL1
SCHEMBL9551933 0.99 AKT1 (0.47) AKT1CETPSYNJ2KDM4EABL1
SCHEMBL13362435 0.99 AKT1 (0.47) AKT1CETPSYNJ2KDM4EABL1
SCHEMBL5704153 0.99 AKT1 (0.47) AKT1CETPSYNJ2KDM4EABL1
SCHEMBL13362538 0.99 AKT1 (0.47) AKT1CETPSYNJ2KDM4EABL1
SCHEMBL5704189 0.99 AKT1 (0.47) AKT1CETPSYNJ2KDM4EABL1
SCHEMBL13362441 0.99 AKT1 (0.47) AKT1CETPSYNJ2KDM4EABL1
SCHEMBL13362431 0.96 SYNJ2 (0.45) AKT1CETPSYNJ2KDM4EABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115308318-A Method for identifying wild Jianghua bitter tea based on extensive targeted metabonomics technology 湖南省茶叶研究所(湖南省茶叶检测中心) 2022-11-08 CN claimed
CN-115308318-A Method for identifying wild Jianghua bitter tea based on extensive targeted metabonomics technology 湖南省茶叶研究所(湖南省茶叶检测中心) 2022-11-08 CN disclosed
US-9670170-B2 Resorufin derivatives for treatment of oxidative stress disorders BIOELECTRON TECHNOLOGY CORPORATION (US) 2017-06-06 US disclosed