SCHEMBL15548838

SCHEMBL15548838

CCCCN1C(=O)CN(CC(=O)O)CC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
MGLL Q99685 3/20 0.41
FAAH O00519 2/20 0.41
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
S1PR1 P21453 1/20 0.38
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.36
PTGS1 P23219 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
NFKB1 P19838 1/20 0.35
APEX1 P27695 1/20 0.35
THPO P40225 1/20 0.35
PMP22 Q01453 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CHRM2 P08172 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
SCHEMBL15550730 0.89 HTT (0.41) KDM4EMGLLFAAHHTTSMN1; SMN2
SCHEMBL15550421 0.82 SMN1; SMN2 (0.42) KDM4EHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL15550136 0.80 KDM4E (0.41) KDM4EMGLLFAAHSMN1; SMN2ALDH1A1
SCHEMBL3489028 0.79 S1PR1 (0.41) KDM4ESMN1; SMN2S1PR1TSHRALDH1A1
SCHEMBL15548788 0.77 TSHR (0.39) KDM4EHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL9016557 0.75 KDM4E (0.47) KDM4EHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL3490964 0.74 KDM4E (0.38) KDM4EHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL15549256 0.74 PIK3CD (0.43) KDM4EHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL14560490 0.72 MC4R (0.49) KDM4EALDH1A1MEN1KMT2ACHRM2
SCHEMBL23105622 0.72 S1PR1 (0.49) SMN1; SMN2S1PR1

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