SCHEMBL2919033

SCHEMBL2919033

CNC(=O)CCC1COCCN1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 2/20 0.33
MALT1 Q9UDY8 1/20 0.33
LMNA P02545 1/20 0.32
MAP4K1 Q92918 1/20 0.31

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
SCHEMBL2909635 0.83 MAP4K1 (0.37) ARG1MALT1MAP4K1
SCHEMBL2327332 0.82 TSHR (0.39) ARG1MALT1LMNA
SCHEMBL2380650 0.81 ARG1 (0.35) ARG1MALT1
SCHEMBL4666386 0.80 ARG1 (0.38) ARG1MALT1
SCHEMBL16771700 0.80 ARG1 (0.38) ARG1MALT1
SCHEMBL16771693 0.80 ARG1 (0.38) ARG1MALT1
SCHEMBL1854210 0.78 ARG1 (0.38) ARG1MALT1
Hydrochloric Acid SCHEMBL16759537 0.78 ARG1 (0.38) ARG1MALT1
Hydrochloric Acid SCHEMBL15573124 0.78 ARG1 (0.38) ARG1MALT1
Hydrochloric Acid SCHEMBL18259318 0.78 ARG1 (0.38) ARG1MALT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1591443-B1 PYRAZOLE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2010-08-25 EP disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-20080125409-A1 1,5-Diheterocycle-1H-Triazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-05-29 US disclosed
US-20080064682-A1 Pyrazole Derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-13 US disclosed
US-20070254881-A1 Pyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
EP-1803719-A1 1,5-DIHETEROCYCLE-1H-TRIAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-07-04 EP disclosed
EP-1785418-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-16 EP disclosed
EP-1762568-A1 PYRAZOLE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-03-14 EP disclosed
US-20060189591-A1 Five-membered heterocyclic derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-08-24 US disclosed
US-20060128685-A1 Pyrazole derivative DAIICHI PHARMACEUTICAL CO., LTD., (JP) 2006-06-15 US disclosed
EP-1621537-A1 FIVE-MEMBERED HETEROCYCLIC DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-02-01 EP disclosed
EP-1591443-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-02 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 (5 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-20080125409-A1 1,5-Diheterocycle-1H-Triazole Derivative PTGS1, PTGER1, TBXA2R ARG1 253/4885MALT1 2788/4885LMNA 4633/4885
US-20070254881-A1 Pyrazole Derivative PTGER1, PTGS1, PTGER2 ARG1 178/4885MALT1 3827/4885LMNA 4599/4885
US-20060128685-A1 Pyrazole derivative PTGS1, PTGS2, PTGER1 ARG1 759/4885MALT1 4362/4885LMNA 4163/4885
US-20080064682-A1 Pyrazole Derivatives NAT1, AR, CBR3 ARG1 346/4885MALT1 2474/4885LMNA 4596/4885
US-20060189591-A1 Five-membered heterocyclic derivative PTGS1, PTGIS, PTGS2 ARG1 1417/4885MALT1 4216/4885LMNA 3156/4885

“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.