SCHEMBL7789774

SCHEMBL7789774

NC(=O)CC(O)C(O)CC(=O)NOCc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.41
PARP10 Q53GL7 1/20 0.41
HPGD P15428 1/20 0.39
IDO1 P14902 2/20 0.39
AGXT P21549 2/20 0.39
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK8 P45983 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.36
NR4A2 P43354 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL7347119 0.86 RAB9A (0.54) MAOBPARP10HPGDAGXTMAPK8
SCHEMBL7792917 0.85 NPC1 (0.51) NPC1RAB9A
SCHEMBL7792926 0.84 MAOB (0.46) MAOBPARP10IDO1AGXTNR4A2
SCHEMBL7793844 0.81 IDO1 (0.44) MAOBIDO1AGXTMAPK8MEN1
SCHEMBL7792899 0.78 ALDH1A1 (0.62) MAOBPARP10IDO1HTTKDM4E
SCHEMBL28809154 0.73 MAOB (0.49) MAOBPARP10IDO1AGXTKDM4E
SCHEMBL7789772 0.73 MAOB (0.40) MAOBPARP10IDO1AGXTKDM4E
SCHEMBL38657612 0.71 NPC1 (0.51) NPC1RAB9A
SCHEMBL5279148 0.70 MAOB (0.51) MAOBPARP10IDO1AGXTKDM4E
SCHEMBL10864025 0.70 IDO1 (0.50) MAOBPARP10IDO1AGXTNPC1

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 1036/4885HPGD 1033/4885

“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.