SCHEMBL5470593

SCHEMBL5470593

COc1ccccc1N1CCC(C#N)(c2cccc(OCc3ccccc3)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.52
LMNA P02545 1/20 0.50
HTR1A P08908 2/20 0.46
DRD4 P21917 2/20 0.46
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
MAOB P27338 1/20 0.43
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42

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
SCHEMBL4881014 0.92 KMT2A (0.57) KMT2ALMNAHTR1ADRD2MAOB
SCHEMBL5475094 0.89 KMT2A (0.55) KMT2AHTR1ADRD4DRD2DRD3
SCHEMBL4870906 0.87 KMT2A (0.67) KMT2AHTR1ADRD4DRD2DRD3
SCHEMBL5480775 0.86 KMT2A (0.57) KMT2AHTR1ADRD4DRD2DRD3
SCHEMBL5469551 0.84 KMT2A (0.53) KMT2ALMNAHTR1ADRD2ALDH1A1
SCHEMBL4880432 0.83 KMT2A (0.62) KMT2AHTR1ADRD4DRD2DRD3
SCHEMBL5470053 0.82 KMT2A (0.55) KMT2AHTR1ADRD2DRD3ADRA1D
SCHEMBL4882594 0.82 DRD2 (0.55) KMT2ALMNAHTR1ADRD2DRD3
SCHEMBL5477018 0.82 GAA (0.50) KMT2ALMNADRD2DRD3ALDH1A1
SCHEMBL5466054 0.82 DRD4 (0.52) KMT2ALMNAHTR1ADRD4DRD2

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-20070078120-A1 Novel piperidine derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-05 US disclosed
EP-1679069-A1 NOVEL PIPERIDINE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-07-12 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-20070078120-A1 Novel piperidine derivative LDLR, PRMT5, MSR1 KMT2A 1301/4885LMNA 1454/4885HTR1A 1323/4885

“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.