SCHEMBL5777067

SCHEMBL5777067

NNc1ccc(-c2cnco2)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 11/20 0.56
IMPDH1 P20839 6/20 0.56
AAK1 Q2M2I8 7/20 0.56
MAP4K4 O95819 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL22170261 0.84 IMPDH2 (0.60) IMPDH2IMPDH1AAK1KDM4ENPC1
SCHEMBL5777545 0.81 IMPDH2 (0.42) IMPDH2IMPDH1AAK1MAP4K4
SCHEMBL29454983 0.79 IMPDH2 (0.60) IMPDH2IMPDH1AAK1MAP4K4KDM4E
SCHEMBL5780722 0.79 IMPDH2 (0.60) IMPDH2IMPDH1AAK1MAP4K4KDM4E
SCHEMBL29541692 0.78 IMPDH2 (0.49) IMPDH2IMPDH1AAK1MAP4K4KDM4E
SCHEMBL14518599 0.78 IMPDH2 (0.68) IMPDH2IMPDH1AAK1
SCHEMBL23493611 0.76 LMNA (0.53) IMPDH2IMPDH1AAK1
SCHEMBL2898349 0.76 GAA (0.53) IMPDH2IMPDH1AAK1MAP4K4
SCHEMBL30177609 0.76 IMPDH2 (0.50) IMPDH2IMPDH1AAK1KDM4ENPC1
SCHEMBL5779997 0.74 RAB9A (0.49) IMPDH2IMPDH1AAK1NPC1RAB9A

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-20060276433-A1 Hydrazone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-07 US disclosed
EP-1612204-A1 HYDRAZONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-04 EP 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-20060276433-A1 Hydrazone derivative APP, PRNP, HTT IMPDH2 4694/4885IMPDH1 4461/4885AAK1 1161/4885

“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.