SCHEMBL5605504

SCHEMBL5605504

O=C(O)CCC(=O)N1CCN(CC(=O)N2CCCC2)CC1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.62
ALDH1A1 P00352 5/20 0.51
TDP1 Q9NUW8 2/20 0.51
KDM4E B2RXH2 1/20 0.51
ATM Q13315 1/20 0.50
MAPT P10636 2/20 0.49
TSHR P16473 2/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.46
GFER P55789 1/20 0.46
RECQL P46063 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
BIRC2 Q13490 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL5606463 0.89 ATM (0.62) GAAALDH1A1TDP1KDM4EATM
SCHEMBL1520620 0.86 ATM (0.65) ALDH1A1TDP1KDM4EATMHSD17B10
SCHEMBL5872643 0.84 GAA (0.65) GAAALDH1A1TDP1KDM4EATM
SCHEMBL1129113 0.84 ATM (0.62) GAAALDH1A1TDP1KDM4EATM
SCHEMBL8788483 0.84 ATM (0.62) GAAALDH1A1TDP1KDM4EATM
SCHEMBL20338317 0.82 GAA (0.69) GAAALDH1A1TDP1KDM4EATM
SCHEMBL7129737 0.82 GAA (0.63) GAAALDH1A1TDP1KDM4EMAPT
SCHEMBL9643768 0.82 GAA (0.50) GAAALDH1A1TDP1KDM4EATM
SCHEMBL20885121 0.82 ALDH1A1 (0.56) ALDH1A1TDP1KDM4EATMMAPT
SCHEMBL7127595 0.80 GAA (0.64) GAAALDH1A1TDP1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166594-B2 Antibacterial activity AVENTIS PHARMA S.A. (FR) 2007-01-23 US disclosed
US-20030149004-A1 Streptogramin derivatives, their preparation and compositions containing them AVENTIS PHARMA S.A. 2003-08-07 US disclosed
US-6569854-B1 Virginamycins AVENTIS PHARMA S.A. (FR) 2003-05-27 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-20030149004-A1 Streptogramin derivatives, their preparation and compositions containing them MRPL21, ABHD5, APEH GAA 2464/4885ALDH1A1 4296/4885TDP1 2611/4885

“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.