SCHEMBL18760239

SCHEMBL18760239

CC(C)(C)OC(=O)CCN(CCN)CCNCCNCC(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
MAOB P27338 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
SCHEMBL20746633 0.92
SCHEMBL18636575 0.85 MAOA (0.35) MAOAMAOB
SCHEMBL6534869 0.84 STING1 (0.33)
SCHEMBL14524031 0.83 MAOA (0.35) MAOAMAOB
SCHEMBL3457655 0.82 EPHX2 (0.33) MAOAMAOB
Hydrochloric Acid SCHEMBL6840669 0.82 MEN1 (0.34)
SCHEMBL8019850 0.80 MAOA (0.35) MAOAMAOB
SCHEMBL19016239 0.80 MAOA (0.35) MAOAMAOB
SCHEMBL18760237 0.79 TDP1 (0.35)
SCHEMBL12791563 0.78 KMT2A (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190142977-A1 GADOLINIUM-BASED CONTRAST AGENTS FOR SENSITIVE DETECTION OF Zn2+ WITH MRI THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-05-16 US disclosed
US-10207013-B2 Gadolinium-based contrast agents for sensitive detection of Zn2+ with MRI THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEMS (US) 2019-02-19 US disclosed
US-20170106103-A1 NEW GADOLINIUM-BASED CONTRAST AGENTS FOR SENSITIVE DETECTION OF Zn2+ WITH MRI THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-04-20 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 (3 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-20190142977-A1 GADOLINIUM-BASED CONTRAST AGENTS FOR SENSITIVE DETECTION OF Zn2+ WITH MRI SLC30A6, SLC30A7, SLC39A11 MAOA 2324/4885MAOB 2028/4885
US-10207013-B2 Gadolinium-based contrast agents for sensitive detection of Zn2+ with MRI SLC30A6, SLC30A7, SLC39A11 MAOA 2324/4885MAOB 2028/4885
US-20170106103-A1 NEW GADOLINIUM-BASED CONTRAST AGENTS FOR SENSITIVE DETECTION OF Zn2+ WITH MRI SLC30A6, SLC30A7, SLC39A11 MAOA 2532/4885MAOB 2152/4885

“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.