SCHEMBL7793844

SCHEMBL7793844

NC(=O)CC(O)C(O)CC(=O)NOCc1ccc(F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.44
AGXT P21549 2/20 0.44
ALDH1A1 P00352 1/20 0.43
MAOB P27338 2/20 0.40
GSK3B P49841 2/20 0.40
BACE1 P56817 2/20 0.40
MAPK8 P45983 1/20 0.39
DPP4 P27487 1/20 0.37
DPP7 Q9UHL4 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPK14 Q16539 3/20 0.35
DPP9 Q86TI2 1/20 0.34
PTGER1 P34995 2/20 0.34
PPARA Q07869 1/20 0.34
KDM5A P29375 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
KDM5B Q9UGL1 1/20 0.33

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
SCHEMBL7792899 0.84 ALDH1A1 (0.62) IDO1ALDH1A1MAOBMAPK8MEN1
SCHEMBL7789774 0.81 MAOB (0.41) IDO1AGXTALDH1A1MAOBMAPK8
SCHEMBL7792926 0.80 MAOB (0.46) IDO1AGXTMAOB
SCHEMBL7793842 0.76 IDO1 (0.43) IDO1AGXTMAOBGSK3BBACE1
SCHEMBL7792917 0.72 NPC1 (0.51)
SCHEMBL7347119 0.70 RAB9A (0.54) AGXTALDH1A1MAOBMAPK8
SCHEMBL30148003 0.67 MAPK8 (0.52) IDO1AGXTMAOBMAPK8
SCHEMBL1115269 0.67 MAPK8 (0.52) IDO1AGXTMAOBMAPK8
SCHEMBL6668911 0.66 IDO1 (0.58) IDO1AGXTALDH1A1MAOBGSK3B
SCHEMBL15255521 0.66 IDO1 (0.58) IDO1AGXTALDH1A1MAOBGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010044547-A1 Antiviral protease inhibitors MEDIVIR AB 2001-11-22 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-20010044547-A1 Antiviral protease inhibitors PEPD, PREP, CTSL IDO1 564/4885AGXT 543/4885ALDH1A1 1578/4885

“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.