SCHEMBL13049193

SCHEMBL13049193

CCOC(=O)CCC(NC(=O)CNC(=O)OC(C)(C)C)C(=O)OCC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.63
▸ KMT2A Q03164 3/20 0.60
▸ POLB P06746 1/20 0.60
▸ CYP1A2 P05177 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ ALDH1A1 P00352 5/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ NOD2 Q9HC29 2/20 0.42
▸ CTSK P43235 4/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MAPT P10636 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ PKM P14618 1/20 0.39
▸ ALOX12 P18054 1/20 0.39

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
SCHEMBL29050982 0.91 L3MBTL1 (0.52) L3MBTL1KMT2APOLBCYP1A2CYP2C9
SCHEMBL26895138 0.91 L3MBTL1 (0.52) L3MBTL1KMT2APOLBCYP1A2CYP2C9
SCHEMBL29051020 0.89 L3MBTL1 (0.50) L3MBTL1KMT2APOLBCYP1A2CYP2C9
SCHEMBL29488056 0.89 L3MBTL1 (0.50) L3MBTL1KMT2APOLBCYP1A2CYP2C9
SCHEMBL14586331 0.87 CYP1A2 (0.52) L3MBTL1KMT2APOLBCYP1A2CYP2C9
SCHEMBL2721298 0.86 CYP1A2 (0.68) L3MBTL1KMT2APOLBCYP1A2CYP2C9
SCHEMBL2721300 0.86 CYP1A2 (0.68) L3MBTL1KMT2APOLBCYP1A2CYP2C9
SCHEMBL13049192 0.85 KMT2A (0.50) L3MBTL1KMT2APOLBCYP1A2CYP2C9
SCHEMBL29051009 0.85 NOD2 (0.62) L3MBTL1KMT2APOLBNOD2CTSK
SCHEMBL29488062 0.85 NOD2 (0.62) L3MBTL1KMT2APOLBNOD2CTSK

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-8338643-B2 Reagent for introduction of protein or gene WASEDA UNIVERSITY (JP) 2012-12-25 — — US disclosed
US-20100291672-A1 REAGENT FOR INTRODUCTION OF PROTEIN OR GENE WASEDA UNIVERSITY (JP) 2010-11-18 — — 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-20100291672-A1 REAGENT FOR INTRODUCTION OF PROTEIN OR GENE C1S, SGMS1, CERT1 L3MBTL1 80/4885KMT2A 1785/4885POLB 3728/4885

“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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