SCHEMBL28293605

SCHEMBL28293605

COP(=O)(CCC(C)O)OC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
UGT2B7 P16662 2/20 0.35
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL17616655 0.80 TRPM8 (0.44) ALDH1A1UGT2B7
SCHEMBL6748583 0.75 CYP2C19 (0.34) ALDH1A1CYP2C19LMNATDP1
SCHEMBL1085895 0.74 ALDH1A1 (0.36) ALDH1A1TDP1
SCHEMBL31503108 0.73 UGT2B7 (0.31) UGT2B7
SCHEMBL4693695 0.73 FAAH (0.35)
SCHEMBL27886626 0.71 UGT2B7 (0.34) UGT2B7CYP2C19
SCHEMBL11660658 0.70 ALDH1A1 (0.48) ALDH1A1TDP1
SCHEMBL28817999 0.70 MAPT (0.42) UGT2B7
SCHEMBL8559328 0.69 GABRP (0.38) UGT2B7
SCHEMBL874478 0.69

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-109790350-A Copolymer compositions with phosphonate group 株式会社可乐丽 2019-05-21 CN disclosed