SCHEMBL5776148

SCHEMBL5776148

Ic1cc(-c2cnco2)ccc1NN=Cc1ccncc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.45
GAA P10253 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 4/20 0.45
MAPT P10636 3/20 0.45
LMNA P02545 2/20 0.45
PTK2 Q05397 1/20 0.43
HTT P42858 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
SRC P12931 1/20 0.39
BRAF P15056 1/20 0.39
KDR P35968 1/20 0.39
POLB P06746 2/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
THRB P10828 1/20 0.38
AAK1 Q2M2I8 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL14742652 0.80 RAB9A (0.55) RAB9AGAASMN1; SMN2NPC1MAPT
SCHEMBL5776228 0.80 RAB9A (0.55) RAB9AGAASMN1; SMN2NPC1MAPT
Hydrochloric Acid SCHEMBL5778200 0.79 RAB9A (0.57) RAB9AGAASMN1; SMN2NPC1MAPT
SCHEMBL5776602 0.78 RAB9A (0.56) RAB9AGAASMN1; SMN2NPC1MAPT
SCHEMBL5778422 0.76 RAB9A (0.49) RAB9AGAASMN1; SMN2NPC1MAPT
SCHEMBL5776687 0.75 ADRA1A (0.44) RAB9AGAASMN1; SMN2NPC1MAPT
SCHEMBL5776255 0.74 CYP11B1 (0.47) RAB9AGAANPC1LMNAPTK2
SCHEMBL5779129 0.73 PTK2 (0.39) RAB9AGAASMN1; SMN2NPC1MAPT
SCHEMBL5777191 0.70 PTK2 (0.44) RAB9AGAASMN1; SMN2NPC1MAPT
SCHEMBL5778811 0.69 NOX1 (0.54) RAB9AGAASMN1; SMN2NPC1MAPT

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 3175/4885SMN1; SMN2 2146/4885

“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.