SCHEMBL208111

SCHEMBL208111

CC(C)(C)OC(=O)N[C@@H]1CN(C=O)CC[C@@H]1NC(=O)c1cc2cc(F)ccc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MLLT1 Q03111 1/20 0.48
▸ PYGL P06737 4/20 0.47
▸ PYGM P11217 1/20 0.45
▸ F10 P00742 3/20 0.44
▸ GHSR Q92847 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMYD3 Q9H7B4 1/20 0.42
▸ DRD1 P21728 1/20 0.41
▸ DRD4 P21917 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ CYP51A1 Q16850 1/20 0.40
▸ HRH4 Q9H3N8 1/20 0.40
▸ PARP1 P09874 1/20 0.39

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
SCHEMBL12035676 0.80 MLLT1 (0.51) MLLT1PYGLPYGMF10GHSR
SCHEMBL4265020 0.80 MLLT1 (0.51) MLLT1PYGLPYGMF10GHSR
SCHEMBL2943145 0.80 MLLT1 (0.51) MLLT1PYGLPYGMF10GHSR
SCHEMBL4269561 0.78 F10 (0.60) MLLT1PYGLPYGMF10GHSR
SCHEMBL3341346 0.77 F10 (0.52) MLLT1PYGLPYGMF10GHSR
SCHEMBL3341344 0.77 F10 (0.52) MLLT1PYGLPYGMF10GHSR
SCHEMBL2941401 0.77 F10 (0.52) MLLT1PYGLPYGMF10GHSR
SCHEMBL4261278 0.77 F10 (0.61) F10SMYD3
SCHEMBL4261102 0.77 F10 (0.61) F10SMYD3
SCHEMBL4261105 0.77 F10 (0.61) F10SMYD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088796-B2 Triamine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-01-03 — — US disclosed
US-8088796-B2 Triamine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-01-03 — — US disclosed
US-8088796-B2 Triamine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-01-03 — — US disclosed
US-20090239857-A1 TRIAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-24 — — US disclosed
US-20090239857-A1 TRIAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-24 — — US disclosed
US-20090239857-A1 TRIAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-24 — — US disclosed
EP-1864982-A1 TRIAMINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-12-12 — — 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-20090239857-A1 TRIAMINE DERIVATIVE F2, F12, F3 MLLT1 399/4885PYGL 1747/4885PYGM 3083/4885

“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.

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