SCHEMBL7792926

SCHEMBL7792926

NC(=O)CC(O)C(O)CC(=O)NOCc1cccc(F)c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.46
PARP10 Q53GL7 1/20 0.46
IDO1 P14902 2/20 0.44
AGXT P21549 2/20 0.44
MAOA P21397 1/20 0.44
SCN9A Q15858 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
NR4A2 P43354 2/20 0.41
HCAR2 Q8TDS4 1/20 0.41

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
SCHEMBL7789774 0.84 MAOB (0.41) MAOBPARP10IDO1AGXTNR4A2
SCHEMBL7792917 0.84 NPC1 (0.51)
SCHEMBL7793844 0.80 IDO1 (0.44) MAOBIDO1AGXT
SCHEMBL7792899 0.76 ALDH1A1 (0.62) MAOBPARP10IDO1SCN9A
SCHEMBL7792922 0.76 MAOB (0.45) MAOBPARP10IDO1AGXTMAOA
SCHEMBL11911577 0.76 CNR2 (0.51)
SCHEMBL7347119 0.76 RAB9A (0.54) MAOBPARP10AGXT
SCHEMBL9278982 0.70 IDO1 (0.60) MAOBPARP10IDO1AGXTTAAR1
SCHEMBL38657612 0.70 NPC1 (0.51)
SCHEMBL29747227 0.70 HCAR2 (0.60) MAOBPARP10IDO1AGXTTAAR1

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 MAOB 1597/4885PARP10 1036/4885IDO1 564/4885

“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.