SCHEMBL31429658

SCHEMBL31429658

CC(C)(C)OC(=O)C(C1CCCCC1)(C1CCCCC1)P(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.38
GAA P10253 1/20 0.36
EPHX1 P07099 3/20 0.36
HPGD P15428 1/20 0.34
MMP2 P08253 5/20 0.32
CA12 O43570 4/20 0.32
CA1 P00915 4/20 0.32
CA2 P00918 4/20 0.32
CA9 Q16790 4/20 0.32
MMP8 P22894 1/20 0.32
MMP1 P03956 1/20 0.32
MMP3 P08254 1/20 0.32
SSTR4 P31391 1/20 0.31
BTK Q06187 1/20 0.31
ANPEP P15144 2/20 0.31
ERAP2 Q6P179 2/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
CNR2 P34972 1/20 0.30

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
SCHEMBL20635363 0.77 DGAT1 (0.43) DGAT1GAAEPHX1HPGDSSTR4
SCHEMBL28077248 0.75 DGAT1 (0.45) DGAT1GAAEPHX1HPGDSSTR4
SCHEMBL27950403 0.74 GAA (0.41) DGAT1GAAEPHX1HPGDSSTR4
SCHEMBL28201093 0.73 DGAT1 (0.39) DGAT1GAAEPHX1HPGDSSTR4
SCHEMBL6597535 0.72 DGAT1 (0.42) DGAT1GAAEPHX1HPGDSSTR4
SCHEMBL28077255 0.71 EPHX1 (0.39) DGAT1GAAEPHX1HPGDCHRM2
SCHEMBL27843694 0.71 CTSS (0.36) DGAT1GAAEPHX1HPGDBTK
SCHEMBL6512299 0.70 DGAT1 (0.41) DGAT1GAAEPHX1HPGDBTK
SCHEMBL1372061 0.70 DGAT1 (0.46) DGAT1GAAEPHX1HPGDCA12
SCHEMBL26605075 0.70 DGAT1 (0.37) DGAT1GAAEPHX1HPGDSSTR4

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-119350422-B Deubiquitinase targeting chimeric compound and preparation method and application thereof 中国药科大学 2025-04-04 CN disclosed
CN-119350422-A Deubiquitinase targeting chimeric compound and preparation method and application thereof 中国药科大学 2025-01-24 CN disclosed