SCHEMBL5779393

SCHEMBL5779393

CN(C)c1ccc(C=NNc2cccc(I)c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.64
RAB9A P51151 8/20 0.64
KMT2A Q03164 6/20 0.64
GAA P10253 6/20 0.64
MEN1 O00255 5/20 0.64
POLB P06746 2/20 0.64
KLF5 Q13887 1/20 0.64
MPO P05164 2/20 0.57
APP P05067 1/20 0.54
L3MBTL1 Q9Y468 4/20 0.50
NOX1 Q9Y5S8 2/20 0.47
NOX3 Q9HBY0 1/20 0.47
NOX4 Q9NPH5 1/20 0.47
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
MAPT P10636 5/20 0.46
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
GFER P55789 1/20 0.46

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
SCHEMBL5779390 1.00 NPC1 (0.64) NPC1RAB9AKMT2AGAAMEN1
SCHEMBL5779169 0.82 MPO (0.72) NPC1RAB9AKMT2AGAAMEN1
SCHEMBL5779166 0.82 MPO (0.72) NPC1RAB9AKMT2AGAAMEN1
SCHEMBL6663830 0.82 MPO (0.71) NPC1RAB9AKMT2AGAAMEN1
SCHEMBL2681678 0.82 MPO (0.71) NPC1RAB9AKMT2AGAAMEN1
SCHEMBL12258152 0.79 NPC1 (1.00) NPC1RAB9AKMT2AGAAMEN1
SCHEMBL5775875 0.78 RAB9A (0.68) NPC1RAB9AKMT2AGAAMEN1
SCHEMBL22198258 0.76 APP (0.69) NPC1RAB9AKMT2AMEN1APP
SCHEMBL12235651 0.71 NPC1 (0.59) NPC1RAB9AKMT2AGAAMEN1
SCHEMBL6565822 0.70 RAB9A (0.62) NPC1RAB9AKMT2AGAAMEN1

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 NPC1 952/4885RAB9A 3127/4885KMT2A 3533/4885

“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.