SCHEMBL5606463

SCHEMBL5606463

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

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.62
GAA P10253 1/20 0.58
L3MBTL1 Q9Y468 2/20 0.49
ALDH1A1 P00352 6/20 0.48
TDP1 Q9NUW8 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
TSHR P16473 2/20 0.46
CYP1A2 P05177 1/20 0.46
MAPK1 P28482 1/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
KDM4E B2RXH2 2/20 0.46
GFER P55789 1/20 0.44
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43

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
SCHEMBL5605504 0.89 GAA (0.62) ATMGAAL3MBTL1ALDH1A1TDP1
SCHEMBL14500981 0.87 ATM (0.82) ATML3MBTL1ALDH1A1TDP1MEN1
SCHEMBL13879753 0.85 ATM (0.78) ATML3MBTL1ALDH1A1TDP1MEN1
SCHEMBL10568276 0.81 ATM (0.71) ATML3MBTL1ALDH1A1TDP1MEN1
SCHEMBL8518504 0.81 ATM (0.71) ATML3MBTL1ALDH1A1TDP1MEN1
SCHEMBL5872643 0.81 GAA (0.65) ATMGAAALDH1A1TDP1MEN1
SCHEMBL20338317 0.80 GAA (0.69) ATMGAAALDH1A1TDP1MEN1
SCHEMBL7129737 0.80 GAA (0.63) GAAALDH1A1TDP1MEN1KMT2A
SCHEMBL29237194 0.80 ATM (0.68) ATML3MBTL1ALDH1A1TDP1MEN1
SCHEMBL5605768 0.79 HSD11B1 (0.53) ATML3MBTL1ALDH1A1TDP1MEN1

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 ATM 2840/4885GAA 2464/4885L3MBTL1 3947/4885

“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.