SCHEMBL9504920

SCHEMBL9504920

COC(=O)c1ncoc1-c1ccc2c(c1)OCO2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.48
ALDH1A1 P00352 6/20 0.48
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
TP53 P04637 3/20 0.48
HPGD P15428 3/20 0.48
MAPT P10636 2/20 0.48
HSD17B10 Q99714 2/20 0.48
GAA P10253 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 6/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
PKM P14618 2/20 0.48
RAB9A P51151 5/20 0.47
HCRTR2 O43614 1/20 0.46

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
SCHEMBL1967729 0.79 HCRTR2 (0.46) KMT2AMEN1GAANPC1HCRTR2
SCHEMBL8135631 0.77 GSK3B (0.51) KDM4EKMT2AMEN1GAAADORA2A
SCHEMBL3743984 0.77 NOTUM (0.52) KDM4EMAPTGAAPKM
SCHEMBL14564447 0.76 MEN1 (0.55) KDM4EALDH1A1KMT2AMEN1HPGD
SCHEMBL6372051 0.75 ADORA2A (0.60) KDM4EALDH1A1KMT2AMEN1TP53
SCHEMBL27905112 0.75 KDM4E (0.47) KDM4EALDH1A1KMT2AMEN1HPGD
SCHEMBL1931754 0.75 GAA (0.65) KDM4EALDH1A1KMT2AMEN1MAPT
SCHEMBL1969272 0.75 ADORA2A (0.64) KDM4EALDH1A1KMT2AMEN1HPGD
SCHEMBL24572924 0.75 KMT2A (0.51) KDM4EALDH1A1KMT2AMEN1TP53
SCHEMBL2819846 0.74 GSK3B (0.48) KDM4EALDH1A1KMT2AMEN1MAPT

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-0375554-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE THREO-DIHYDROXYPHENYLSERINE DERIVATIVES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1993-05-05 EP disclosed
EP-0375554-A2 Process for producing optically active threo-dihydroxyphenylserine derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-06-27 EP disclosed