SCHEMBL29136160

SCHEMBL29136160

CC=CCC(=O)OC(=O)CCCCC=CCCCCCCC1C=CCC1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
ALOX15 P16050 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
USP2 O75604 1/20 0.57
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
EPHX2 P34913 2/20 0.32
CNR2 P34972 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
SCHEMBL29136186 0.84 ALDH1A1 (0.64) ALDH1A1ALOX15TDP1USP2CYP3A4
SCHEMBL3318021 0.79 ALDH1A1 (0.55) ALDH1A1ALOX15TDP1USP2CYP3A4
SCHEMBL3318018 0.79 ALDH1A1 (0.55) ALDH1A1ALOX15TDP1USP2CYP3A4
SCHEMBL3401110 0.79 ALDH1A1 (0.55) ALDH1A1ALOX15TDP1USP2CYP3A4
SCHEMBL3320979 0.79 ALDH1A1 (0.55) ALDH1A1ALOX15TDP1USP2CYP3A4
SCHEMBL3320980 0.79 ALDH1A1 (0.55) ALDH1A1ALOX15TDP1USP2CYP3A4
SCHEMBL3401107 0.79 ALDH1A1 (0.55) ALDH1A1ALOX15TDP1USP2CYP3A4
SCHEMBL12794399 0.77 ALDH1A1 (0.53) ALDH1A1ALOX15TDP1USP2CYP3A4
SCHEMBL12794355 0.76 ALDH1A1 (0.60) ALDH1A1ALOX15TDP1USP2CYP3A4
SCHEMBL3400540 0.76 ALDH1A1 (0.60) ALDH1A1ALOX15TDP1USP2CYP3A4

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