SCHEMBL12508570

SCHEMBL12508570

O=C(Nc1cccnc1)N1CCN(C(=O)c2ccnc(OCC3CCCCC3)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.46
ALDH1A1 P00352 1/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
NAMPT P43490 5/20 0.45
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
CYP2D6 P10635 1/20 0.43

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
SCHEMBL12508573 0.91 ALDH1A1 (0.49) FAAHALDH1A1NAMPTCYP2D6
SCHEMBL12509406 0.89 ALDH1A1 (0.48) FAAHALDH1A1HTR2AHTR2CNAMPT
SCHEMBL12509399 0.88 MGLL (0.51) FAAHALDH1A1HTR2AHTR2C
SCHEMBL12509070 0.88 MGLL (0.51) FAAHALDH1A1HTR2AHTR2C
SCHEMBL12508869 0.88 MGLL (0.51) FAAHALDH1A1HTR2AHTR2C
SCHEMBL12509253 0.87 NAMPT (0.50) FAAHALDH1A1HTR2AHTR2CNAMPT
SCHEMBL12508860 0.87 NAMPT (0.50) FAAHALDH1A1HTR2AHTR2CNAMPT
SCHEMBL12508867 0.87 NAMPT (0.50) FAAHALDH1A1HTR2AHTR2CNAMPT
SCHEMBL12509403 0.86 PDE4A (0.47) FAAHALDH1A1HTR2AHTR2CNAMPT
SCHEMBL12509036 0.86 ALDH1A1 (0.50) FAAHALDH1A1HTR2AHTR2CNAMPT

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-20110172230-A1 UREA COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-07-14 US disclosed
EP-2065369-A1 UREA COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2009-06-03 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-20110172230-A1 UREA COMPOUND OR SALT THEREOF FAAH, FAAH2, UTS2R FAAH 1/4885ALDH1A1 259/4885HTR2A 3213/4885

“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.