SCHEMBL20707263

SCHEMBL20707263

CC1(C)OC[C@@H](CCCCOS(C)(=O)=O)O1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.51
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
ALOX15 P16050 2/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
MMP9 P14780 1/20 0.46
TSHR P16473 1/20 0.46
NPSR1 Q6W5P4 1/20 0.35
PPARA Q07869 3/20 0.30
MEN1 O00255 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
PKM P14618 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30
CASP1 P29466 1/20 0.30
BLM P54132 1/20 0.30
KMT2A Q03164 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
SCHEMBL9152538 1.00 CA2 (0.51) CA2ALDH1A1KDM4EALOX15USP2
SCHEMBL2748061 0.95 CA2 (0.53) CA2ALDH1A1KDM4EALOX15USP2
SCHEMBL2077365 0.89 CA2 (0.55) CA2ALDH1A1KDM4EALOX15USP2
SCHEMBL369753 0.89 CA2 (0.55) CA2ALDH1A1KDM4EALOX15USP2
SCHEMBL1901250 0.89 CA2 (0.55) CA2ALDH1A1KDM4EALOX15USP2
SCHEMBL17392767 0.82 CA2 (0.56) CA2ALDH1A1KDM4EALOX15USP2
SCHEMBL1222790 0.79 CA2 (0.73) CA2ALDH1A1KDM4EALOX15NPSR1
SCHEMBL1416178 0.79 CA2 (0.73) CA2ALDH1A1KDM4EALOX15NPSR1
SCHEMBL849140 0.79 CA2 (0.73) CA2ALDH1A1KDM4EALOX15NPSR1
SCHEMBL13607512 0.79 CA2 (0.42) CA2ALDH1A1TSHRNPSR1

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
EP-3438155-B1 BIODEGRADABLE HYDROGEL HAVING CYCLIC BENZYLIDENE ACETAL STRUCTURE NOF CORP (JP) 2023-09-06 EP disclosed
EP-3438155-A1 BIODEGRADABLE HYDROGEL HAVING CYCLIC BENZYLIDENE ACETAL STRUCTURE NOF Corporation (JP) 2019-02-06 EP disclosed