SCHEMBL5779994

SCHEMBL5779994

C(=NNc1ccc(-c2cnco2)cc1)c1nc2c(s1)CNCC2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WNT1 P04628 1/20 0.34
GSK3B P49841 1/20 0.34
DYRK1A Q13627 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
JAK3 P52333 1/20 0.33
NPC1 O15118 4/20 0.33
PKM P14618 3/20 0.33
RAB9A P51151 3/20 0.33
LMNA P02545 2/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NOTUM Q6P988 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.32
CASP3 P42574 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
IMPDH2 P12268 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
SCHEMBL5779327 0.80 ROCK2 (0.47) KMT2AMEN1JAK3PKMLMNA
SCHEMBL5776711 0.78 BRD4 (0.40) KMT2AMEN1JAK3NPC1PKM
SCHEMBL5779808 0.73 GPR119 (0.46) MAPT
SCHEMBL5779815 0.73 GPR119 (0.46) MAPT
SCHEMBL5778469 0.71 PTK2 (0.41) KMT2AMEN1JAK3NPC1PKM
SCHEMBL5775757 0.70 JAK3 (0.47) KMT2AMEN1JAK3NPC1RAB9A
SCHEMBL5775753 0.70 JAK3 (0.47) KMT2AMEN1JAK3NPC1RAB9A
SCHEMBL5780289 0.69 IMPDH2 (0.38) KMT2AMEN1NPC1PKMRAB9A
SCHEMBL14742652 0.68 RAB9A (0.55) KMT2AMEN1NPC1PKMRAB9A
SCHEMBL5778811 0.68 NOX1 (0.54) KMT2AMEN1NPC1PKMRAB9A

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 WNT1 479/4885GSK3B 3318/4885DYRK1A 4185/4885

“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.