SCHEMBL9575455

SCHEMBL9575455

CCOC(=O)c1ccccc1NC(=O)c1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.80
LMNA P02545 3/20 0.80
SMN1; SMN2 Q16637 4/20 0.74
POLB P06746 3/20 0.74
TP53 P04637 2/20 0.74
TDP1 Q9NUW8 2/20 0.74
ALDH1A1 P00352 4/20 0.70
HPGD P15428 1/20 0.70
MAPK1 P28482 1/20 0.70
ELANE P08246 1/20 0.69
PRTN3 P24158 1/20 0.69
NPSR1 Q6W5P4 3/20 0.68
HTT P42858 2/20 0.68
TSHR P16473 6/20 0.67
GAA P10253 2/20 0.67
RECQL P46063 1/20 0.67
HSD17B10 Q99714 4/20 0.67
MEN1 O00255 1/20 0.65
MAPT P10636 1/20 0.65
KMT2A Q03164 1/20 0.65

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
SCHEMBL31730773 1.00 KDM4E (0.80) KDM4ELMNASMN1; SMN2POLBTP53
SCHEMBL14855680 0.97 KDM4E (0.76) KDM4ELMNASMN1; SMN2POLBTP53
SCHEMBL14855798 0.93 SMN1; SMN2 (0.75) KDM4ELMNASMN1; SMN2POLBTP53
SCHEMBL14856210 0.92 KDM4E (0.69) KDM4ELMNASMN1; SMN2POLBTP53
SCHEMBL28026288 0.90 KDM4E (0.66) KDM4ELMNASMN1; SMN2POLBTP53
SCHEMBL14855679 0.90 POLB (0.72) KDM4ELMNASMN1; SMN2POLBTP53
SCHEMBL10325817 0.89 KDM4E (0.76) KDM4ELMNASMN1; SMN2POLBTP53
SCHEMBL15186932 0.89 KDM4E (0.65) KDM4ELMNASMN1; SMN2POLBTP53
SCHEMBL10914245 0.88 KDM4E (0.63) KDM4ELMNASMN1; SMN2POLBTP53
SCHEMBL29028434 0.88 KDM4E (0.70) KDM4ELMNASMN1; SMN2POLBTP53

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
EP-0280367-B1 Glycine compounds SHELL INT RESEARCH (NL) 1993-11-03 EP disclosed
US-5110348-A Pre-and postemergence SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1992-05-05 US disclosed
EP-0280367-A2 Glycine compounds SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-08-31 EP disclosed