SCHEMBL15548784

SCHEMBL15548784

O=C1CN(CO)CC(=O)N1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 3/20 0.47
TOP2B Q02880 3/20 0.47
PTGS1 P23219 2/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CRBN Q96SW2 3/20 0.39
PKM P14618 1/20 0.34
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.30
CYP2C9 P11712 1/20 0.30
CASP3 P42574 1/20 0.30
CASP2 P42575 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
SCHEMBL728996 0.78 TOP2A (0.50) TOP2ATOP2BPTGS1LMNAMAPT
SCHEMBL16349791 0.74 TOP2A (0.52) TOP2ATOP2BPTGS1LMNAMAPT
SCHEMBL9752550 0.74 TOP2A (0.47) TOP2ATOP2BPTGS1LMNAMAPT
SCHEMBL5945932 0.73 PTGS1 (0.42) TOP2ATOP2BPTGS1LMNAMAPT
SCHEMBL561442 0.72
SCHEMBL14431370 0.72
SCHEMBL15549254 0.72 PTGS1 (0.41) TOP2ATOP2BPTGS1LMNAMAPT
SCHEMBL31377154 0.70 APEX1 (0.42) TOP2ATOP2BPTGS1LMNAMAPT
SCHEMBL29130872 0.70 PTGS1 (0.44) TOP2ATOP2BPTGS1LMNAMAPT
SCHEMBL5707893 0.70 TOP2A (0.48) TOP2ATOP2BPTGS1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10364262-B2 Method for the synthesis of N-phosphonomethyliminodiacetic acid MONSANTO TECHNOLOGY LLC (US) 2019-07-30 US disclosed
US-20150166584-A1 METHOD FOR THE SYNTHESIS OF N-PHOSPHONOMETHYLIMINODIACETIC ACID MONSANTO TECHNOLOGY LLC 2015-06-18 US disclosed
EP-2875038-A1 METHOD FOR THE SYNTHESIS OF N-PHOSPHONOMETHYLIMINODIACETIC ACID Straitmark Holding AG (CH) 2015-05-27 EP disclosed
WO-2014012986-A1 METHOD FOR THE SYNTHESIS OF N-PHOSPHONOMETHYLIMINODIACETIC ACID STRAITMARK HOLDING AG (CH) 2014-01-23 WO disclosed