SCHEMBL28328720

SCHEMBL28328720

C=C(C(=O)OC(C)(C)C)C1COCCO1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GAA P10253 1/20 0.31
RECQL P46063 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL28374907 0.86 ALDH1A1 (0.35) USP2SMN1; SMN2GAAALDH1A1
SCHEMBL28120828 0.81 ALDH1A1 (0.34) ALDH1A1
SCHEMBL29988783 0.80 USP2 (0.41) USP2SMN1; SMN2GAARECQL
Hydrochloric Acid SCHEMBL29356070 0.78 USP2 (0.40) USP2SMN1; SMN2GAARECQL
SCHEMBL9615848 0.73
SCHEMBL27865318 0.73 ALDH1A1 (0.33) ALDH1A1
SCHEMBL18787641 0.73 USP2 (0.36) USP2SMN1; SMN2GAARECQLALDH1A1
SCHEMBL19573843 0.72 GAA (0.38) USP2SMN1; SMN2GAAALDH1A1
Oxirane SCHEMBL28109280 0.71 SMN1; SMN2 (0.46) USP2SMN1; SMN2GAARECQLALDH1A1
SCHEMBL351189 0.71 ALDH1A1 (0.35) ALDH1A1

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-110325585-A Polyvinyl alcohol compositions and its purposes 株式会社可乐丽 2019-10-11 CN disclosed
CN-110312738-A The preparation method of vinyl polymers 株式会社可乐丽 2019-10-08 CN disclosed