SCHEMBL28839191

SCHEMBL28839191

CCOCCOCCOC(=O)C1(C)COC(=O)OC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
ATM Q13315 1/20 0.37
THRB P10828 2/20 0.37
MEN1 O00255 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
CHRM2 P08172 4/20 0.32
CHRM1 P11229 4/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
SLC22A1 O15245 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
PRCP P42785 1/20 0.32
HTT P42858 1/20 0.32
TMEM97 Q5BJF2 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL2053633 0.98 ALDH1A1 (0.42) ALDH1A1TSHRATMTHRBMEN1
SCHEMBL10267707 0.91 ATM (0.34) ALDH1A1TSHRATMTHRBCHRM2
SCHEMBL846905 0.88 SMN1; SMN2 (0.34) ALDH1A1TSHRATMMEN1KMT2A
SCHEMBL17589272 0.88 SMN1; SMN2 (0.34) ALDH1A1TSHRATMMEN1KMT2A
SCHEMBL866817 0.88 MEN1 (0.33) TSHRATMMEN1KMT2A
SCHEMBL10260787 0.84 ATM (0.37) ALDH1A1TSHRATMCHRM1LMNA
SCHEMBL663919 0.84 ATM (0.50) ALDH1A1TSHRATMMEN1BLM
SCHEMBL847892 0.83 SMN1; SMN2 (0.36) ALDH1A1TSHRATMMEN1KMT2A
SCHEMBL12966247 0.82 PRKCA (0.40) ALDH1A1ATM
SCHEMBL10314811 0.81 PRKCA (0.40) ALDH1A1TSHRATMMEN1KMT2A

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-114051530-A Cell scaffold material, cell culture support, and method for culturing cells 昭和电工材料株式会社 2022-02-15 CN disclosed