SCHEMBL5779035

SCHEMBL5779035

Nc1ccc(-c2cnco2)c(I)c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 5/20 0.60
IMPDH1 P20839 3/20 0.60
MAP4K4 O95819 1/20 0.51
PTK2 Q05397 1/20 0.39
NOTUM Q6P988 1/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
AAK1 Q2M2I8 6/20 0.35
KEAP1 Q14145 1/20 0.34

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
SCHEMBL8347880 0.81 IMPDH2 (0.62) IMPDH2IMPDH1MAP4K4PTK2NOTUM
SCHEMBL6168364 0.79 IMPDH2 (0.65) IMPDH2IMPDH1MAP4K4PTK2NOTUM
SCHEMBL5780722 0.79 IMPDH2 (0.60) IMPDH2IMPDH1MAP4K4PTK2NOTUM
SCHEMBL6170749 0.79 IMPDH2 (0.60) IMPDH2IMPDH1MAP4K4PTK2NOTUM
SCHEMBL6169923 0.79 IMPDH2 (0.60) IMPDH2IMPDH1MAP4K4PTK2NOTUM
SCHEMBL29454983 0.79 IMPDH2 (0.60) IMPDH2IMPDH1MAP4K4PTK2NOTUM
SCHEMBL5777545 0.79 IMPDH2 (0.42) IMPDH2IMPDH1MAP4K4AAK1
SCHEMBL12907859 0.76 IMPDH2 (0.60) IMPDH2IMPDH1MAP4K4PTK2NOTUM
SCHEMBL16238614 0.76 IMPDH2 (0.56) IMPDH2IMPDH1MAP4K4PTK2NOTUM
SCHEMBL926045 0.76 IMPDH2 (0.56) IMPDH2IMPDH1MAP4K4PTK2NOTUM

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 4461/4885MAP4K4 4009/4885

“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.