SCHEMBL15549256

SCHEMBL15549256

CC(C)CN1C(=O)CN(CC(=O)O)CC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
NFKB1 P19838 1/20 0.42
PTGS1 P23219 1/20 0.42
APEX1 P27695 1/20 0.42
THPO P40225 1/20 0.42
PMP22 Q01453 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.40
POLB P06746 1/20 0.39
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.38
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35

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
SCHEMBL15550421 0.79 SMN1; SMN2 (0.42) MEN1KMT2ALMNACYP3A4CYP2C9
SCHEMBL15549869 0.79 PIK3CD (0.47) PIK3CDMEN1KMT2ALMNACYP3A4
SCHEMBL15548706 0.78 ENPP2 (0.41) PIK3CDMEN1KMT2ALMNACYP3A4
SCHEMBL15550730 0.76 HTT (0.41) MEN1KMT2ALMNACYP3A4CYP2C9
SCHEMBL15548788 0.75 TSHR (0.39) PIK3CDMEN1KMT2ALMNACYP3A4
SCHEMBL15550729 0.74 MEN1 (0.36) PIK3CDMEN1KMT2ALMNACYP3A4
SCHEMBL15548838 0.74 KDM4E (0.41) MEN1KMT2ALMNACYP3A4CYP2C9
SCHEMBL8295107 0.72 PIK3CD (0.47) PIK3CDMEN1KMT2ALMNACYP3A4
SCHEMBL16409457 0.71 PIK3CD (0.59) PIK3CDCYP3A4SMN1; SMN2ALDH1A1
SCHEMBL20758548 0.71 PIK3CD (0.59) PIK3CDCYP3A4SMN1; 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 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