SCHEMBL29136169

SCHEMBL29136169

CCCCC(C)CCCC(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.51
TSHR P16473 1/20 0.51
ATM Q13315 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MAPT P10636 1/20 0.49
DGKA P23743 1/20 0.47
LMNA P02545 4/20 0.44
KMT2A Q03164 3/20 0.44
POLB P06746 1/20 0.44
ALDH1A1 P00352 1/20 0.43
PAM P19021 2/20 0.43
ACE2 Q9BYF1 1/20 0.43
KDM4E B2RXH2 1/20 0.42
DUSP3 P51452 1/20 0.42
NR1I2 O75469 1/20 0.42
PGR P06401 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
PTGS2 P35354 1/20 0.42
PDE4D Q08499 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
SCHEMBL434247 0.92 KMT2A (0.47) CYP1A2CYP3A4TSHRATMTDP1
SCHEMBL28954693 0.89 MAPT (0.59) CYP1A2CYP3A4TSHRATMTDP1
SCHEMBL9779602 0.87 ACE2 (0.50) CYP1A2CYP3A4TSHRATMTDP1
SCHEMBL11589262 0.87 CYP1A2 (0.50) CYP1A2CYP3A4TSHRATMTDP1
SCHEMBL19936386 0.87 DGKA (0.55) CYP3A4TSHRATMTDP1MAPT
SCHEMBL3116497 0.86 CYP1A2 (0.53) CYP1A2CYP3A4TSHRATMTDP1
SCHEMBL11657591 0.85 CYP1A2 (0.48) CYP1A2CYP3A4TSHRATMTDP1
SCHEMBL29134114 0.85 ACE2 (0.53) CYP1A2MAPTDGKALMNAKMT2A
SCHEMBL2245530 0.85 CYP1A2 (0.52) CYP1A2CYP3A4TSHRATMTDP1
SCHEMBL31612037 0.85 CYP1A2 (0.52) CYP1A2CYP3A4TSHRATMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117338661-A Application of light peel papaya peel in preparation of cosmetics 安康学院 2024-01-05 CN claimed
CN-117338661-A Application of light peel papaya peel in preparation of cosmetics 安康学院 2024-01-05 CN disclosed