SCHEMBL5776602

SCHEMBL5776602

C(=NNc1cccc(-c2cnco2)c1)c1ccncc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.56
GAA P10253 8/20 0.56
NPC1 O15118 8/20 0.56
MAPT P10636 7/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
POLB P06746 3/20 0.50
LMNA P02545 1/20 0.50
GFER P55789 1/20 0.50
THRB P10828 1/20 0.48
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
MAP4K4 O95819 1/20 0.46
PTK2 Q05397 1/20 0.45
HTT P42858 1/20 0.41
CDK5 Q00535 1/20 0.41
CDK5R1 Q15078 1/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41

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
SCHEMBL5776228 0.84 RAB9A (0.55) RAB9AGAANPC1MAPTSMN1; SMN2
SCHEMBL14742652 0.84 RAB9A (0.55) RAB9AGAANPC1MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL5778200 0.83 RAB9A (0.57) RAB9AGAANPC1MAPTSMN1; SMN2
SCHEMBL5776148 0.78 RAB9A (0.45) RAB9AGAANPC1MAPTSMN1; SMN2
SCHEMBL5779997 0.78 RAB9A (0.49) RAB9AGAANPC1MAPTSMN1; SMN2
SCHEMBL5778422 0.78 RAB9A (0.49) RAB9AGAANPC1MAPTSMN1; SMN2
SCHEMBL5778806 0.76 NOX1 (0.54) RAB9AGAANPC1MAPTSMN1; SMN2
SCHEMBL5778811 0.76 NOX1 (0.54) RAB9AGAANPC1MAPTSMN1; SMN2
SCHEMBL5776687 0.74 ADRA1A (0.44) RAB9AGAANPC1MAPTSMN1; SMN2
SCHEMBL5776531 0.73 MAPT (0.61) RAB9AGAANPC1MAPTSMN1; 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 RAB9A 3127/4885GAA 3175/4885NPC1 952/4885

“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.