SCHEMBL6774687

SCHEMBL6774687

CCOC(=O)C(C(=O)OCC)N(Cc1cccc(N)c1)C(C)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 6/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ LMNA P02545 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ HSD11B1 P28845 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ OPRK1 P41145 1/20 0.38
▸ MEP1B Q16820 1/20 0.38
▸ MAPK1 P28482 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ AOC3 Q16853 1/20 0.36
▸ TSPO P30536 1/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36
▸ TLR7 Q9NYK1 1/20 0.36
▸ TP53 P04637 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
SCHEMBL6782412 0.83 LMNA (0.45) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL27475763 0.83 L3MBTL1 (0.60) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL7176514 0.83 F10 (0.49) MEP1B
SCHEMBL6775308 0.82 ALDH1A1 (0.41) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL7192522 0.81 ALDH1A1 (0.40) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL7176695 0.81 MEP1A (0.46) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL6776253 0.80 CYP1A2 (0.50) ALDH1A1LMNASMN1; SMN2MAPK1MAPT
SCHEMBL2688609 0.76 LMNA (0.48) L3MBTL1ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL413698 0.76 SMN1; SMN2 (0.47) L3MBTL1ALDH1A1HSD11B1SMN1; SMN2MEP1B
SCHEMBL24166883 0.75 HSD11B1 (0.58) ALDH1A1POLBHSD11B1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833382-B2 By muta-synthesis using a mutated micro-organism to influence the biosynthesis of at least one of the precursors of group B streptogramines; mutant strain employed is preferably derived from the strain S. pristinaespiralis SP92 AVENTIS PHARMA S.A. (FR) 2004-12-21 — — US disclosed
US-20020142947-A1 STREPTOGRAMINS AND METHOD FOR PREPARING SAME BY MUTASYNTHESIS AVENTIS PHARMA, S.A. 2002-10-03 — — US disclosed
US-6384014-B1 ANTIBIOTICS AS BACTERICIDES AVENTIS PHARMA S.A. (FR) 2002-05-07 — — US disclosed
US-6352839-B1 PREPARING VIRGINIAMYCINS FROM AN ENGINEERED MICROORGANISMS, HAVING THE ABILITY TO PREVENT BIOSYNTHESIS OF THE PRECURSOR ANTIBIOTIC; THE MICROORGANISM IS CULTURED IN THE PRESENCE OF A SECOND PRECURSOR AND THE STREPTOGRAMIN ANALOG IS RECOVERED AVENTIS PHARMA S.A. (FR) 2002-03-05 — — 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-20020142947-A1 STREPTOGRAMINS AND METHOD FOR PREPARING SAME BY MUTASYNTHESIS EMG1, FBL, SMS L3MBTL1 2328/4885ALDH1A1 3856/4885LMNA 929/4885

“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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