SCHEMBL4367132

SCHEMBL4367132

CCCCCCCCCCCCCCCC(=O)NCCCC(C(=O)O)N1CCN(CC(=O)O)Cc2cccc(n2)CN(CC(=O)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALB P02768 1/20 0.46
FOLH1 Q04609 5/20 0.40
NOD1 Q9Y239 1/20 0.39
DRD2 P14416 2/20 0.37
HTR1A P08908 1/20 0.37
EPHX2 P34913 1/20 0.36
ASAH1 Q13510 1/20 0.36
MEN1 O00255 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
KMT2A Q03164 1/20 0.36
NAMPT P43490 1/20 0.36
MTNR1A P48039 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP8 P22894 1/20 0.36
MMP12 P39900 1/20 0.36
MMP14 P50281 1/20 0.36

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
SCHEMBL4364577 0.88 ALB (0.42) ALBFOLH1DRD2MEN1KMT2A
SCHEMBL15388951 0.82 EPHX2 (0.36) ALBNOD1DRD2EPHX2ASAH1
SCHEMBL4372295 0.81 ALB (0.38) ALBFOLH1
SCHEMBL15389358 0.81 NAPEPLD (0.45)
SCHEMBL15389537 0.80 SOAT2 (0.46) ALBEPHX2MEN1CNR1CNR2
SCHEMBL15389549 0.80 SOAT2 (0.46) ALBEPHX2MEN1CNR1CNR2
SCHEMBL4369094 0.79 ALB (0.39) ALBFOLH1
SCHEMBL4366967 0.79 ALB (0.36) ALBFOLH1
SCHEMBL23723184 0.78 ALB (0.56) ALBFOLH1NOD1EPHX2MMP2
SCHEMBL4364627 0.76 ENPP2 (0.34) ALBDRD2HTR1A

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-9770520-B2 Chelate nanoemulsion for MRI GUERBET (FR) 2017-09-26 US disclosed
US-20130309176-A1 CHELATE NANOEMULSION FOR MRI UNIVERSITE DE BORDEAUX 1 (FR) 2013-11-21 US disclosed
US-8268810-B2 Lipophilic chelates and their use in imaging GUERBET (FR) 2012-09-18 US disclosed
US-20090214441-A1 Lipophilic Chelates and Their Use in Imaging GUERBET (FR) 2009-08-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090214441-A1 Lipophilic Chelates and Their Use in Imaging SLC40A1, TSPO, SLC47A2 ALB 1926/4885FOLH1 186/4885NOD1 2456/4885
US-20130309176-A1 CHELATE NANOEMULSION FOR MRI SGMS1, SGMS2, PHOSPHO1 ALB 149/4885FOLH1 1125/4885NOD1 3584/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.