SCHEMBL3132993

SCHEMBL3132993

CN(C)NC(=O)C1CCC(NC(=O)c2cc3cc(Cl)ccc3[nH]2)C(N)C1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 2/20 0.55
F10 P00742 10/20 0.51
PYGL P06737 7/20 0.50
F2 P00734 1/20 0.48
PLAT P00750 1/20 0.48
EHMT2 Q96KQ7 1/20 0.47

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
SCHEMBL3132972 0.89 SMYD3 (0.51) SMYD3F10PYGLF2PLAT
SCHEMBL10476693 0.89 F10 (0.62) SMYD3F10PYGLF2PLAT
Hydrochloric Acid SCHEMBL1503926 0.88 F10 (0.62) SMYD3F10PYGLF2PLAT
Hydrochloric Acid SCHEMBL1503925 0.88 F10 (0.62) SMYD3F10PYGLF2PLAT
Hydrochloric Acid SCHEMBL2936214 0.86 SMYD3 (0.61) SMYD3F10PYGLEHMT2
Hydrochloric Acid SCHEMBL2936213 0.86 SMYD3 (0.61) SMYD3F10PYGLEHMT2
Hydrochloric Acid SCHEMBL3335719 0.86 SMYD3 (0.61) SMYD3F10PYGLEHMT2
Trifluoroacetic Acid SCHEMBL4093913 0.83 F10 (0.57) SMYD3F10PYGLF2PLAT
SCHEMBL3143578 0.83 F10 (0.49) SMYD3F10PYGLF2PLAT
SCHEMBL1855761 0.82 SMYD3 (0.70) SMYD3F10PYGLEHMT2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8344180-B2 Hydrazine amide derivative SHIONOGI & CO., LTD. (JP) 2013-01-01 US claimed
US-20100004295-A1 Hydrazine amide derivative SHIONOGI & CO., LTD. 2010-01-07 US claimed
EP-2062878-A1 HYDRAZINE AMIDE DERIVATIVE Shionogi&Co., Ltd. (JP) 2009-05-27 EP claimed
US-8344180-B2 Hydrazine amide derivative SHIONOGI & CO., LTD. (JP) 2013-01-01 US disclosed
EP-2062878-A1 HYDRAZINE AMIDE DERIVATIVE Shionogi&Co., Ltd. (JP) 2009-05-27 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-20100004295-A1 Hydrazine amide derivative NPY5R, NPY1R, NPY2R SMYD3 1907/4885F10 2231/4885PYGL 4051/4885

“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.