SCHEMBL16589745

SCHEMBL16589745

CC(C)(C)C(=O)NC(CCC(N)=O)C(=O)NCCN

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GRIA1 P42261 1/20 0.43
▸ SIRT6 Q8N6T7 1/20 0.38
▸ SIRT1 Q96EB6 1/20 0.38
▸ DPP4 P27487 1/20 0.37
▸ DPP8 Q6V1X1 1/20 0.37
▸ DPP9 Q86TI2 1/20 0.37
▸ BMP1 P13497 1/20 0.36
▸ NMT2 O60551 2/20 0.36
▸ NMT1 P30419 2/20 0.36
▸ CCKBR P32239 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TACR1 P25103 1/20 0.34
▸ TACR3 P29371 1/20 0.34
▸ MMP1 P03956 1/20 0.34
▸ MMP3 P08254 1/20 0.34
▸ MMP9 P14780 1/20 0.34
▸ TDP1 Q9NUW8 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
SCHEMBL16589748 0.88 CCKBR (0.45) GRIA1SIRT6SIRT1CCKBR
SCHEMBL16589722 0.85 GRIA1 (0.44) GRIA1SIRT6SIRT1TACR1TACR3
SCHEMBL16589733 0.85 GRIA1 (0.36) GRIA1DPP4DPP8DPP9BMP1
SCHEMBL16589724 0.84 SIRT6 (0.55) GRIA1SIRT6SIRT1NMT2NMT1
SCHEMBL16589738 0.81 GRIA1 (0.46) GRIA1SIRT6SIRT1NMT2NMT1
SCHEMBL16589742 0.81 CTSS (0.46) GRIA1SIRT6SIRT1
SCHEMBL16589746 0.81 GRIA1 (0.45) GRIA1SIRT6SIRT1NMT2NMT1
SCHEMBL16589725 0.80 GRIA1 (0.45) GRIA1SIRT6SIRT1SMN1; SMN2TACR1
SCHEMBL15359494 0.79 NMT1 (0.41) SIRT6SIRT1DPP4DPP8DPP9
SCHEMBL16589749 0.79 GRIA1 (0.44) GRIA1SIRT6SIRT1CCKBRTACR1

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-20150087688-A1 PRODRUGS OF HYDROXYL-COMPRISING DRUGS ASCENDIS PHARMA GMBH (DE) 2015-03-26 — — US disclosed
US-20150087688-A1 PRODRUGS OF HYDROXYL-COMPRISING DRUGS ASCENDIS PHARMA GMBH (DE) 2015-03-26 — — 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-20150087688-A1 PRODRUGS OF HYDROXYL-COMPRISING DRUGS ABCB1, CYP2D6, LDHA GRIA1 3272/4885SIRT6 1290/4885SIRT1 789/4885

“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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