SCHEMBL5772436

SCHEMBL5772436

CN(C)Cc1ccc(/C=N/Nc2ccc(-c3cnco3)c(I)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 14/20 0.35
IMPDH1 P20839 6/20 0.35
GSK3B P49841 1/20 0.35
AAK1 Q2M2I8 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MPO P05164 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.32

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
SCHEMBL5772437 1.00 IMPDH2 (0.35) IMPDH2IMPDH1GSK3BAAK1NPC1
SCHEMBL5779016 0.87 IMPDH2 (0.39) IMPDH2IMPDH1AAK1NPC1RAB9A
SCHEMBL5779013 0.87 IMPDH2 (0.39) IMPDH2IMPDH1AAK1NPC1RAB9A
SCHEMBL5779782 0.83 LMNA (0.40) IMPDH2IMPDH1GSK3BAAK1NPC1
SCHEMBL5779785 0.83 LMNA (0.40) IMPDH2IMPDH1GSK3BAAK1NPC1
SCHEMBL5778422 0.83 RAB9A (0.49) IMPDH2NPC1RAB9APOLBMAPT
SCHEMBL5778054 0.78 MAOA (0.52) IMPDH2NPC1RAB9APOLBMAPT
SCHEMBL5778057 0.78 MAOA (0.52) IMPDH2NPC1RAB9APOLBMAPT
SCHEMBL5780415 0.76 PKM (0.35) IMPDH2IMPDH1AAK1NPC1RAB9A
SCHEMBL5779118 0.76 MAPT (0.44) NPC1RAB9APOLBMAPTSMN1; SMN2

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 4461/4885GSK3B 3318/4885

“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.