SCHEMBL13445975

SCHEMBL13445975

[N-]=[N+]=NCC(=O)NCCCC[C@H](NC(=O)CCN1C(=O)C=CC1=O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 10/20 0.42
▸ FOLH1 Q04609 9/20 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
SCHEMBL13464206 1.00 ALB (0.42) ALBFOLH1
SCHEMBL13446006 0.89 ALB (0.35) ALBFOLH1
SCHEMBL30361214 0.87 FOLH1 (0.41) ALBFOLH1
SCHEMBL13445980 0.84 TSHR (0.32) ALB
SCHEMBL13464208 0.84 TSHR (0.32) ALB
SCHEMBL12946729 0.82 NOD1 (0.49) ALB
SCHEMBL22389098 0.81 ALB (0.47) ALBFOLH1
SCHEMBL23077727 0.78 GLP1R (0.49) ALBFOLH1
SCHEMBL15919171 0.78 GLP1R (0.49) ALBFOLH1
SCHEMBL17287165 0.78 GLP1R (0.49) ALBFOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2288388-B1 ACHIEVEMENT OF HIGH THERAPEUTIC INDEX THROUGH MOLECULAR IMAGING GUIDED TARGETED DRUG TREATMENT SIEMENS MEDICAL SOLUTIONS (US) 2016-08-31 — — EP disclosed
US-20100074910-A1 Achievement of a high therapeutic index through molecular imaging guided targeted drug treatment SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2010-03-25 — — 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-20100074910-A1 Achievement of a high therapeutic index through molecular imaging guided targeted drug treatment MKI67, CD47, CD68 ALB 237/4885FOLH1 12/4885

“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.

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