SCHEMBL8914937

SCHEMBL8914937

CCOC(=O)C1=C(N)C(=O)O[C@@H]1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 7/20 0.41
HTT P42858 3/20 0.41
HSD17B10 Q99714 1/20 0.41
GAA P10253 4/20 0.41
HPGD P15428 3/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 1/20 0.40
MAOA P21397 1/20 0.40
POLB P06746 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
AHR P35869 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL8916232 0.81 ALDH1A1 (0.46) KDM4ELMNAALDH1A1HTTHSD17B10
SCHEMBL8915432 0.80 ALDH1A1 (0.36) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL13486531 0.79 LMNA (0.43) KDM4ELMNAALDH1A1HTTHSD17B10
SCHEMBL13486541 0.77 LMNA (0.45) KDM4ELMNAALDH1A1HTTHSD17B10
SCHEMBL8915454 0.74 GLA (0.40) KDM4ELMNAALDH1A1HTTHSD17B10
SCHEMBL13486543 0.74 KDM4E (0.39) KDM4ELMNAALDH1A1HTTHSD17B10
SCHEMBL17603301 0.66 TSHR (0.53) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL17603302 0.66 TSHR (0.53) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL11669385 0.66 KDM4E (0.67) KDM4ELMNAALDH1A1HTTHSD17B10
Urethane SCHEMBL844947 0.66 ALOX15 (0.58) KDM4ELMNAALDH1A1HTTHSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5625059-A Process for the manufacture of 4-acetoxy-3-hydroxyethyl-azetidinone CIBA-GEIGY CORPORATION (US) 1997-04-29 US disclosed
US-5312914-A Process for the manufacture of 4-acetoxy-3-hydroxyethyl-azetidinone CIBA-GEIGY CORP (US) 1994-05-17 US disclosed
EP-0279781-A2 Process for the preparation of 4-acetoxy-3-hydroxyethyl-acetidinone CIBA-GEIGY AG (CH) 1988-08-24 EP disclosed