SCHEMBL5778897

SCHEMBL5778897

IC=Cc1ccc(NN=Cc2ccncc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.62
GAA P10253 8/20 0.62
NPC1 O15118 7/20 0.62
KMT2A Q03164 2/20 0.56
MAPT P10636 9/20 0.55
SMN1; SMN2 Q16637 6/20 0.55
POLB P06746 2/20 0.55
THRB P10828 1/20 0.55
LMNA P02545 5/20 0.47
GFER P55789 2/20 0.47
HTT P42858 1/20 0.46
CDK5 Q00535 1/20 0.46
CDK5R1 Q15078 1/20 0.46
SRC P12931 1/20 0.45
BRAF P15056 1/20 0.45
KDR P35968 1/20 0.45
NOX1 Q9Y5S8 2/20 0.44
ALDH1A1 P00352 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 1/20 0.42

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
SCHEMBL5778611 0.81 RAB9A (0.68) RAB9AGAANPC1KMT2AMAPT
SCHEMBL14832820 0.78 RAB9A (0.97) RAB9AGAANPC1KMT2AMAPT
SCHEMBL11124641 0.78 RAB9A (0.97) RAB9AGAANPC1KMT2AMAPT
SCHEMBL14831808 0.78 RAB9A (0.69) RAB9AGAANPC1KMT2AMAPT
SCHEMBL11127223 0.78 RAB9A (0.69) RAB9AGAANPC1KMT2AMAPT
SCHEMBL11127219 0.78 NOX1 (0.74) RAB9AGAANPC1KMT2AMAPT
SCHEMBL14438165 0.78 NOX1 (0.74) RAB9AGAANPC1KMT2AMAPT
SCHEMBL10032044 0.76
SCHEMBL881829 0.76 RAB9A (1.00) RAB9AGAANPC1KMT2AMAPT
SCHEMBL5777496 0.76 RAB9A (1.00) RAB9AGAANPC1KMT2AMAPT

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.