SCHEMBL4724872

SCHEMBL4724872

COc1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SUV39H2 Q9H5I1 12/20 0.59
MAPT P10636 3/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
ALK Q9UM73 2/20 0.56
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
MAPK1 P28482 1/20 0.53
HTT P42858 1/20 0.53
ABCB1 P08183 1/20 0.52
PDK2 Q15119 1/20 0.50

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
SCHEMBL1639007 0.90 SUV39H2 (0.60) SUV39H2MAPTSMN1; SMN2ALKALDH1A1
SCHEMBL15797078 0.87 MAPT (0.72) MAPTSMN1; SMN2ALDH1A1LMNAMAPK1
SCHEMBL30208188 0.87 MAPT (0.72) MAPTSMN1; SMN2ALDH1A1LMNAMAPK1
SCHEMBL18013315 0.87 PDK2 (0.53) SUV39H2MAPTSMN1; SMN2ALKALDH1A1
SCHEMBL13162408 0.86 SUV39H2 (0.61) SUV39H2MAPTSMN1; SMN2ALKALDH1A1
SCHEMBL21533625 0.86 MAPT (0.63) SUV39H2MAPTSMN1; SMN2ALKALDH1A1
SCHEMBL15862951 0.85 LMNA (0.54) SUV39H2MAPTSMN1; SMN2ALKALDH1A1
SCHEMBL31195734 0.85 ALK (0.55) SUV39H2MAPTSMN1; SMN2ALKALDH1A1
SCHEMBL4930175 0.85 MAPT (0.58) SUV39H2MAPTSMN1; SMN2ALKALDH1A1
SCHEMBL18588079 0.84 MAPT (0.56) SUV39H2MAPTSMN1; SMN2ALKALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1396487-B1 PHENYLPYRIDINE CARBONYL PIPERAZINE DERIVATIVE ASTELLAS PHARMA INC (JP) 2008-12-10 EP disclosed
US-7196080-B2 Respiratory system disordeers; chronic obstructive pulminary disease ASTELLAS PHARMA INC. (JP) 2007-03-27 US disclosed
US-20040192701-A1 Phenlypyridine carbonyl piperazine derivative ASTELLAS PHARMA INC. (JP) 2004-09-30 US disclosed
EP-1396487-A1 PHENYLPYRIDINE CARBONYL PIPERAZINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2004-03-10 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-20040192701-A1 Phenlypyridine carbonyl piperazine derivative PDE5A, PDE4A, PDE3B SUV39H2 317/4885MAPT 4798/4885SMN1; SMN2 4250/4885

“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.