SCHEMBL5658247

SCHEMBL5658247

CCOc1ccccc1N(CCN1CCN(c2ccccn2)CC1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.53
DRD2 P14416 2/20 0.53
HTR2A P28223 2/20 0.53
DRD4 P21917 2/20 0.50
HRH3 Q9Y5N1 4/20 0.49
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47

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
SCHEMBL5657707 0.94 HTR1A (0.59) HTR1ADRD2HTR2ADRD4HRH3
SCHEMBL5655625 0.91 ALDH1A1 (0.56) HTR1ADRD2HTR2ADRD4ALDH1A1
SCHEMBL5657912 0.89 HTR1A (0.50) HTR1ADRD2DRD4HRH3ALDH1A1
SCHEMBL5659556 0.89 HTR4 (0.43) HTR1ADRD2HTR2AADRA1A
SCHEMBL5657837 0.87 HTR1A (0.56) HTR1ADRD2HTR2ADRD4HRH3
SCHEMBL5655977 0.86 HTR1A (0.41) HTR1ADRD2HTR2AALDH1A1ADRA1A
SCHEMBL5659379 0.85 LMNA (0.44) HTR1ADRD4ALDH1A1ADRA1DADRA1A
SCHEMBL5656351 0.84 HTR1A (0.57) HTR1ADRD2HTR2AHRH3ALDH1A1
SCHEMBL5657181 0.83 OPRM1 (0.54) HTR1ADRD2HTR2ADRD4HRH3
SCHEMBL5656672 0.83 HTR1A (0.57) HTR1ADRD2DRD4ALDH1A1ADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof CEREP (FR) 2004-03-25 US claimed
US-7238693-B2 Aryl carbamate derivatives, preparation and use thereof CEREP (FR) 2007-07-03 US disclosed
US-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof CEREP (FR) 2004-03-25 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-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof HTR4, HTR5A, HTR3C HTR1A 8/4885DRD2 73/4885HTR2A 14/4885

“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.