SCHEMBL8448270

SCHEMBL8448270

CCOC(=O)C(=NOC)c1ccccc1C1OCCCO1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.36
GAA P10253 2/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 5/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
HSD17B10 Q99714 2/20 0.35
HIF1A Q16665 2/20 0.35
MAPT P10636 3/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
PLIN1 O60240 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
PLIN5 Q00G26 1/20 0.34
ABHD5 Q8WTS1 1/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL8448269 1.00 KDM4E (0.36) KDM4EGAATSHRSMN1; SMN2ALDH1A1
SCHEMBL8463855 0.95 TSHR (0.38) KDM4ETSHRSMN1; SMN2ALDH1A1KMT2A
SCHEMBL8463857 0.95 TSHR (0.38) KDM4ETSHRSMN1; SMN2ALDH1A1KMT2A
SCHEMBL8463490 0.83 TSHR (0.41) KDM4EGAATSHRSMN1; SMN2ALDH1A1
SCHEMBL8463915 0.81 KDM4E (0.36) KDM4ESMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL8463919 0.81 KDM4E (0.36) KDM4ESMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL8461956 0.79 CYP2C9 (0.34) KDM4ESMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL8460584 0.79 CYP2C9 (0.34) KDM4ESMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL8460590 0.79 CYP2C9 (0.34) KDM4ESMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL8463794 0.78 L3MBTL1 (0.33) KDM4EGAATSHRSMN1; SMN2ALDH1A1

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
JP-11322692-A None JP disclosed
JP-H11322692-A PRODUCTION OF N-METHOXYIMINOPHENYLACETIC ACID ESTER DERIVATIVE MITSUBISHI CHEMICAL CORP 1999-11-24 JP disclosed
EP-0949243-A1 OPTICALLY ACTIVE METHOXYIMINOACETAMIDE DERIVATIVES, PROCESS FOR THE PREPARATION OF THEM, INTERMEDIATES THEREFOR, AND PESTICIDES CONTAINING THEM AS THE ACTIVE INGREDIENT MITSUBISHI CHEMICAL CORPORATION (JP) 1999-10-13 EP disclosed