SCHEMBL18975211

SCHEMBL18975211

O=C(O)CN1CCN(CC(=O)O)CCN(CC(O)CN(CCc2ccccc2)CC(=O)O)CCN(CC(=O)O)CC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 5/20 0.48
PRMT5 O14744 2/20 0.42
WDR77 Q9BQA1 2/20 0.42
ABCB1 P08183 7/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KCNH2 Q12809 1/20 0.39
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL18975269 0.94 BACE1 (0.45) BACE1PRMT5WDR77ABCB1MEN1
SCHEMBL19489857 0.92 BACE1 (0.43) BACE1PRMT5WDR77ABCB1MEN1
SCHEMBL19489854 0.89 BACE1 (0.41) BACE1PRMT5WDR77ABCB1ALDH1A1
SCHEMBL18975189 0.88 ALDH1A1 (0.44) BACE1PRMT5WDR77MEN1KMT2A
SCHEMBL18970111 0.85 TDP1 (0.39) BACE1MEN1KMT2AKDM4EALDH1A1
SCHEMBL5557205 0.84 ALDH1A1 (0.46) BACE1PRMT5WDR77MEN1KMT2A
SCHEMBL22446648 0.82 BACE1 (0.39) BACE1PRMT5WDR77ABCB1ALDH1A1
SCHEMBL18970104 0.82 HSD17B10 (0.38) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL18970241 0.79 SLC6A9 (0.36) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL22730606 0.79 TDP1 (0.34) MEN1KMT2AKDM4EALDH1A1HSD17B10

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
US-11021451-B2 Contrast agents BRACCO IMAGING S.P.A. (IT) 2021-06-01 US disclosed
EP-3386953-B1 CONTRAST AGENTS BRACCO IMAGING SPA (IT) 2020-10-21 EP disclosed
US-20200325108-A1 CONTRAST AGENTS BRACCO IMAGING S.P.A. (IT) 2020-10-15 US disclosed
US-10781188-B2 Contrast agents BRACCO IMAGING S.P.A. (IT) 2020-09-22 US disclosed
WO-2017098038-A1 CONTRAST AGENTS BRACCO IMAGING SPA (IT) 2017-06-15 WO 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-11021451-B2 Contrast agents SLC39A14, ABCB7, SLC40A1 BACE1 4866/4885PRMT5 3077/4885WDR77 3670/4885
US-20200325108-A1 CONTRAST AGENTS SLC39A14, ABCB7, SLC40A1 BACE1 4866/4885PRMT5 3077/4885WDR77 3670/4885
US-10781188-B2 Contrast agents SLC39A14, ABCB7, SLC40A1 BACE1 4866/4885PRMT5 3077/4885WDR77 3670/4885

“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.