SCHEMBL13801264

SCHEMBL13801264

COc1ccccc1C1CCN(C=O)CC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.60
MEN1 O00255 10/20 0.59
KMT2A Q03164 10/20 0.59
HTR2C P28335 2/20 0.57
MAPT P10636 3/20 0.51
ATM Q13315 1/20 0.50
MAPK1 P28482 3/20 0.49
MCOLN2 Q8IZK6 1/20 0.48
MCOLN3 Q8TDD5 1/20 0.48
MCOLN1 Q9GZU1 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL6179061 0.84 PDE4B (0.47) DRD2MEN1KMT2AHTR2C
SCHEMBL22063773 0.82 PDE4B (0.48) DRD2MEN1KMT2AMAPT
SCHEMBL824153 0.81 DRD2 (0.69) DRD2MEN1KMT2AHTR2CMAPT
SCHEMBL1515163 0.80 HTR2C (0.75) DRD2MEN1KMT2AHTR2CATM
SCHEMBL13917718 0.78 MEN1 (0.72) DRD2MEN1KMT2AHTR2CMAPT
SCHEMBL2637185 0.78 MEN1 (0.77) DRD2MEN1KMT2AHTR2CMAPT
SCHEMBL13450162 0.78 HTR2C (0.53) HTR2C
SCHEMBL20400164 0.78 MEN1 (0.54) DRD2MEN1KMT2AHTR2CMAPT
SCHEMBL20400103 0.78 MEN1 (0.53) DRD2MEN1KMT2AHTR2CMAPT
SCHEMBL12099491 0.77 PDE4B (0.55)

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
US-20090163480-A1 Modified amino acids, pharmaceuticals containing these compounds and method for their production DR. KARL THOMAE GMBH (DE) 2009-06-25 US disclosed
US-20090163480-A1 Modified amino acids, pharmaceuticals containing these compounds and method for their production DR. KARL THOMAE GMBH (DE) 2009-06-25 US disclosed
US-7498325-B2 Modified amino acids, pharmaceuticals containing these compounds and method for their production KARL THOMAS GMBH (DE) 2009-03-03 US disclosed
US-7498325-B2 Modified amino acids, pharmaceuticals containing these compounds and method for their production KARL THOMAS GMBH (DE) 2009-03-03 US 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-20090163480-A1 Modified amino acids, pharmaceuticals containing these compounds and method for their production PTMS, CHRM1, SRMS DRD2 187/4885MEN1 596/4885KMT2A 2685/4885

“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.