SCHEMBL29150855

SCHEMBL29150855

CCCCCCCCOC(=O)C=Cc1cc(OC)c(OC)c(OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.51
ABCB1 P08183 4/20 0.50
ABCC1 P33527 4/20 0.50
ABCG2 Q9UNQ0 4/20 0.50
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
ALOX5 P09917 1/20 0.48
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
HCAR2 Q8TDS4 1/20 0.47
AKR1B10 O60218 2/20 0.46
AKR1B1 P15121 2/20 0.46
HTR1A P08908 2/20 0.46
HTR2C P28335 2/20 0.46
HTR2A P28223 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR7 P34969 1/20 0.46
HTR6 P50406 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL10610360 0.85 ABCB1 (0.67) APPABCB1ABCC1ABCG2ALOX5
SCHEMBL10606238 0.85 ABCB1 (0.67) APPABCB1ABCC1ABCG2ALOX5
SCHEMBL27728337 0.82 ALOX5 (0.52) APPABCB1ABCC1ABCG2KDM4E
SCHEMBL1880416 0.82 ABCG2 (0.57) APPABCG2KDM4EALDH1A1ALOX5
SCHEMBL1880415 0.82 ABCG2 (0.57) APPABCG2KDM4EALDH1A1ALOX5
SCHEMBL2226672 0.81 NFE2L2 (0.60) APPKDM4EALDH1A1ALOX5HPGD
SCHEMBL466048 0.81 KDM4E (0.71) APPKDM4EALDH1A1AKR1B10AKR1B1
SCHEMBL8872224 0.81 KDM4E (0.71) APPKDM4EALDH1A1AKR1B10AKR1B1
SCHEMBL4629237 0.81 KDM4E (0.71) APPKDM4EALDH1A1AKR1B10AKR1B1
SCHEMBL4421062 0.81 KDM4E (0.71) APPKDM4EALDH1A1AKR1B10AKR1B1

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-220306024-U Cable with electromagnetic shielding function 郑州三星电缆有限公司 2024-01-05 CN disclosed