SCHEMBL5778002

SCHEMBL5778002

Ic1cc(C=NNc2ccc(-c3cnco3)cc2)ccc1N1CCNCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.35
PIKFYVE Q9Y2I7 1/20 0.33
GHSR Q92847 1/20 0.33
CA2 P00918 3/20 0.32
CA9 Q16790 3/20 0.32
CA7 P43166 2/20 0.32
CA1 P00915 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 1/20 0.32
KDM4E B2RXH2 5/20 0.32
ALDH1A1 P00352 4/20 0.32
NPC1 O15118 4/20 0.32
GAA P10253 3/20 0.32
RAB9A P51151 3/20 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
SCHEMBL5778000 1.00 JAK3 (0.35) JAK3PIKFYVEGHSRCA2CA9
SCHEMBL5779195 0.85 JAK3 (0.41) JAK3CA2CA9CA7CA1
SCHEMBL5779193 0.85 JAK3 (0.41) JAK3CA2CA9CA7CA1
SCHEMBL5779298 0.85 GPR119 (0.38) JAK3PIKFYVEKDM4EALDH1A1GAA
SCHEMBL5779296 0.85 GPR119 (0.38) JAK3PIKFYVEKDM4EALDH1A1GAA
SCHEMBL5775757 0.84 JAK3 (0.47) JAK3CA2CA9CA7CA1
SCHEMBL5775753 0.84 JAK3 (0.47) JAK3CA2CA9CA7CA1
SCHEMBL5779122 0.77 MAPT (0.44) JAK3CA2CA9CA7CA1
SCHEMBL5779118 0.77 MAPT (0.44) JAK3CA2CA9CA7CA1
SCHEMBL5775279 0.75 LMNA (0.36) PIKFYVECYP3A4CYP2D6PSEN1PSEN2

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 JAK3 4560/4885PIKFYVE 4762/4885GHSR 640/4885

“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.