SCHEMBL3154287

SCHEMBL3154287

CCCCCCCCCCCCCCCCCC(=O)OCCOCCNC(=O)CN(CCN(CCN(CC(=O)O)CC(=O)NCCOCCOC(=O)CCCCCCCCCCCCCCCCC)CC(=O)O)CC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.49
EPHX2 P34913 1/20 0.47
DNM1 Q05193 3/20 0.46
TLR2 O60603 3/20 0.43
PAM P19021 2/20 0.43
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GLP1R P43220 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL3153101 0.92 DNM1 (0.49) EPHX2DNM1BLMPMP22HSD17B10
SCHEMBL13934645 0.85 DNM1 (0.42) EPHX2DNM1CA1CA2BLM
Glycol Distearate SCHEMBL1527579 0.85 DGKA (0.68) DGKADNM1TLR2PAMBLM
SCHEMBL14252347 0.84 BLM (0.46) CA1CA2BLMPMP22HSD17B10
SCHEMBL9425809 0.82 DGKA (0.64) DGKAEPHX2DNM1GLP1RL3MBTL1
SCHEMBL10251463 0.82 EPHX2 (0.49) DGKAEPHX2DNM1PAML3MBTL1
SCHEMBL6047711 0.82 ALDH1A1 (0.45) EPHX2CA1CA2BLMPMP22
SCHEMBL3153992 0.80 TSHR (0.44) EPHX2CA1CA2BLMPMP22
SCHEMBL9276251 0.80 DGKA (0.59) DGKADNM1TLR2PAMBLM
SCHEMBL1419852 0.79 CASP2 (0.51) EPHX2DNM1CA1CA2BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1806350-B1 Amphipatic polycarboxylic chelates and complexes with paramagnetic metals as MRI contrast agents BRACCO INT BV (NL) 2010-01-06 EP disclosed
EP-1806350-A2 Amphipatic polycarboxylic chelates and complexes with paramagnetic metals as MRI contrast agents BRACCO International B.V. (NL) 2007-07-11 EP disclosed
US-6652834-B2 Tensioactive properties, long lasting activity in the blood pool BRACCO INTERNATIONAL B.V. (NL) 2003-11-25 US disclosed
US-20020098152-A1 Amphipatic polycarboxylic chelates and complexes with paramagnetic metals as MRI contrast agents BRACCO INTERNATIONAL B.V. 2002-07-25 US disclosed
US-6342598-B1 BLOOD-POOL CONTRAST AGENTS OF OUTSTANDING LONG LIFE IN CIRCULATION BRACCO INTERNATIONAL B.V. (NL) 2002-01-29 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 (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-20020098152-A1 Amphipatic polycarboxylic chelates and complexes with paramagnetic metals as MRI contrast agents SLC39A14, HAMP, PICALM DGKA 2783/4885EPHX2 4596/4885DNM1 266/4885

“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.