SCHEMBL3693813

SCHEMBL3693813

CON[C@@H](CCCNC(=N)N)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ GAA P10253 1/20 0.41
▸ TDP1 Q9NUW8 7/20 0.36
▸ ATM Q13315 2/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ NPY4R P50391 2/20 0.36
▸ NPY1R P25929 1/20 0.36
▸ NPSR1 Q6W5P4 4/20 0.35
▸ POLB P06746 3/20 0.35
▸ MAPT P10636 2/20 0.34
▸ NOS1 P29475 2/20 0.33
▸ NOS3 P29474 1/20 0.33
▸ NOS2 P35228 1/20 0.33
▸ CTSS P25774 1/20 0.32
▸ CTSK P43235 1/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32

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
SCHEMBL13863591 0.85 MEN1 (0.42) MEN1KMT2AGAATDP1ATM
Hydrochloric Acid SCHEMBL3700024 0.82 NPY4R (0.36) KMT2ANPY4RNPY1RPOLB
SCHEMBL10676657 0.82 TDP1 (0.42) MEN1KMT2AGAATDP1ATM
SCHEMBL27484587 0.82 MEN1 (0.40) MEN1KMT2AGAATDP1ATM
SCHEMBL27484588 0.82 MEN1 (0.40) MEN1KMT2AGAATDP1ATM
SCHEMBL27810936 0.81 C3AR1 (0.37) MEN1KMT2AGAANPY4RNPY1R
SCHEMBL27468052 0.81 MEN1 (0.39) MEN1KMT2AGAATDP1ATM
SCHEMBL27468053 0.81 MEN1 (0.39) MEN1KMT2AGAATDP1ATM
SCHEMBL604855 0.80 MEN1 (0.45) MEN1KMT2AGAATDP1MAOA
SCHEMBL604856 0.80 MEN1 (0.45) MEN1KMT2AGAATDP1MAOA

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
US-9387185-B2 N-ω-hydroxy-L-arginine derivatives for the treatment of diseases CHRISTIAN-ALBRECHTS-UNIVERSITÄT ZU KIEL (DE) 2016-07-12 — — US disclosed
US-20120123111-A1 Nª -Hydroxy-L-Arginine Derivatives for the Treatment of Diseases CHRISTIAN-ALBRECHTS-UNIVERSITAET ZU KIEL (DE) 2012-05-17 — — 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-20120123111-A1 Nª -Hydroxy-L-Arginine Derivatives for the Treatment of Diseases ARG2, ARG1, NOS2 MEN1 2465/4885KMT2A 1003/4885GAA 704/4885

“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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