SCHEMBL26017775

SCHEMBL26017775

CCOC(=O)C(CCCNC(=N)N)NC(=O)CC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.47
▸ POLB P06746 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ NPY1R P25929 7/20 0.43
▸ NPY4R P50391 7/20 0.43
▸ NPY5R Q15761 7/20 0.43
▸ NPY2R P49146 4/20 0.43
▸ NOD1 Q9Y239 3/20 0.41
▸ CAD P27708 1/20 0.39
▸ C3AR1 Q16581 1/20 0.37
▸ MEN1 O00255 1/20 0.36

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
SCHEMBL18465137 0.90 NPY4R (0.43) KMT2APOLBNPY1RNPY4RNPY5R
SCHEMBL21879811 0.89 KMT2A (0.42) KMT2APOLBL3MBTL1NPY1RNPY4R
SCHEMBL5812127 0.87 SIRT6 (0.43) KMT2APOLBL3MBTL1NPY1RNPY4R
SCHEMBL5812133 0.87 SIRT6 (0.43) KMT2APOLBL3MBTL1NPY1RNPY4R
SCHEMBL13261943 0.86 NOD1 (0.58) KMT2APOLBL3MBTL1NPY1RNPY4R
SCHEMBL1541677 0.86 NOD1 (0.58) KMT2APOLBL3MBTL1NPY1RNPY4R
SCHEMBL4522102 0.86 NOD1 (0.58) KMT2APOLBL3MBTL1NPY1RNPY4R
SCHEMBL21842547 0.86 NOD1 (0.58) KMT2APOLBL3MBTL1NPY1RNPY4R
SCHEMBL7651136 0.86 NOD1 (0.58) KMT2APOLBL3MBTL1NPY1RNPY4R
SCHEMBL359000 0.86 NOD1 (0.58) KMT2APOLBL3MBTL1NPY1RNPY4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265039-A1 METHOD FOR PRODUCING ESTER BASED ON ECO-FRIENDLY AND HIGH-EFFICIENCY ESTERIFICATION BY USING BASE EXCHANGE OF SALT AND THE COMPOUND THEREOF WOODWARD BIO CORP. (KR) 2023-08-24 — — 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-20230265039-A1 METHOD FOR PRODUCING ESTER BASED ON ECO-FRIENDLY AND HIGH-EFFICIENCY ESTERIFICATION BY USING BASE EXCHANGE OF SALT AND THE COMPOUND THEREOF SLC6A9, TST, SLC6A5 KMT2A 2581/4885POLB 1871/4885L3MBTL1 1660/4885

“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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