SCHEMBL3296288

SCHEMBL3296288

CN(C)n1cc(C(=O)O)c(=O)c2cc(SCCOCCNC(=O)OC(C)(C)C)ccc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.35
CNR2 P34972 1/20 0.35
DDB1 Q16531 3/20 0.35
CRBN Q96SW2 3/20 0.35
IDO1 P14902 3/20 0.35
KDM4E B2RXH2 2/20 0.33
PLK1 P53350 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
MALT1 Q9UDY8 1/20 0.33
BRD4 O60885 1/20 0.32

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
SCHEMBL3293003 0.93 IDO1 (0.36) IDO1KDM4EALDH1A1HPGDTSHR
SCHEMBL3288612 0.84 DDB1 (0.43) BCHECNR2DDB1CRBNIDO1
SCHEMBL3289243 0.83 LMNA (0.40) IDO1KDM4EALDH1A1HPGDRAB9A
Trifluoroacetic Acid SCHEMBL3288201 0.80 KDM4E (0.37) KDM4EALDH1A1HPGDTSHRRAB9A
SCHEMBL3293923 0.79 P2RY14 (0.39) CNR2DDB1CRBNKDM4EALDH1A1
SCHEMBL3983498 0.79 ALDH1A1 (0.51) KDM4EALDH1A1HPGDTSHRRAB9A
SCHEMBL3983514 0.79 ALDH1A1 (0.51) KDM4EALDH1A1HPGDTSHRRAB9A
SCHEMBL3812384 0.78 ALDH1A1 (0.46) KDM4EALDH1A1HPGDTSHRRAB9A
SCHEMBL3291726 0.78 CA12 (0.44) BCHECNR2KDM4EALDH1A1HPGD
SCHEMBL4396358 0.77 ALDH1A1 (0.48) KDM4EALDH1A1HPGDTSHRRAB9A

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-7718621-B2 Macrolones—amino substituted quinolones GLAXO GROUP LTD. (GB) 2010-05-18 US disclosed
US-20080090773-A1 Macrolones - Amino Substituted Quinolones GLAXO GROUP LIMITED (GB) 2008-04-17 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-20080090773-A1 Macrolones - Amino Substituted Quinolones MRPL21, Q6ZSR9, QARS1 BCHE 2344/4885CNR2 4675/4885DDB1 2059/4885

“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.