SCHEMBL4359589

SCHEMBL4359589

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

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 2/20 0.38
POLB P06746 2/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 1/20 0.35
TACR1 P25103 3/20 0.34
DRD3 P35462 1/20 0.33
ALB P02768 1/20 0.33

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
SCHEMBL4369094 0.88 ALB (0.39) SLC6A9HSD17B10POLBMAPK1LMNA
SCHEMBL4359522 0.86 BACE1 (0.39) MAPTLMNA
SCHEMBL4372295 0.85 ALB (0.38) SLC6A9HSD17B10POLBMAPK1LMNA
SCHEMBL9205301 0.85 EGLN1 (0.40) SLC6A9HSD17B10MAPTPOLB
SCHEMBL4366967 0.84 ALB (0.36) SLC6A9LMNATACR1ALB
SCHEMBL1394889 0.83 SLC6A9 (0.42) SLC6A9HSD17B10MAPTPOLB
SCHEMBL16800516 0.83 SLC6A9 (0.40) SLC6A9POLBTACR1
SCHEMBL1673149 0.83 SLC6A9 (0.39) SLC6A9HSD17B10POLBMAPK1TACR1
SCHEMBL4364577 0.81 ALB (0.42) MAPTLMNADRD3ALB
SCHEMBL4368905 0.81 ALB (0.40) SLC6A9MAPTLMNAALB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268810-B2 Lipophilic chelates and their use in imaging GUERBET (FR) 2012-09-18 US disclosed
US-8268810-B2 Lipophilic chelates and their use in imaging GUERBET (FR) 2012-09-18 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
US-20090214441-A1 Lipophilic Chelates and Their Use in Imaging GUERBET (FR) 2009-08-27 US disclosed
US-20090214441-A1 Lipophilic Chelates and Their Use in Imaging GUERBET (FR) 2009-08-27 US disclosed
EP-1885721-B1 METAL CHELATES OF POLYAMINOCARBOXYLIC MACROCYCLIC DERIVATIVES AND USE THEREOF IN DIAGNOSTIC IMAGING GUERBET SA (FR) 2009-07-29 EP 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 (1 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 SLC6A9 229/4885HSD17B10 3272/4885MAPT 1232/4885

“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.