SCHEMBL5656003

SCHEMBL5656003

COc1ccccc1N(CCN1CCN(c2cccc(C)c2)CC1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.52
DRD2 P14416 2/20 0.47
DRD3 P35462 2/20 0.47
POLB P06746 1/20 0.46
GFER P55789 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HTR7 P34969 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HTR1A P08908 2/20 0.46
DRD4 P21917 2/20 0.45
HTT P42858 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL5657423 0.94 KCNH2 (0.56) KCNH2DRD2DRD3HTR7MEN1
SCHEMBL5658365 0.91 HTR1A (0.56) KCNH2DRD2DRD3GFERMEN1
SCHEMBL5655859 0.90 GFER (0.55) DRD3POLBGFERHTR7MEN1
SCHEMBL5657971 0.90 KCNH2 (0.50) KCNH2DRD2DRD3HSD17B10HTR7
SCHEMBL5655713 0.90 MEN1 (0.57) KCNH2HTR7MEN1KMT2AHTR1A
SCHEMBL5655788 0.89 POLB (0.51) DRD2DRD3POLBGFERHTR7
SCHEMBL5656027 0.86 TSHR (0.56) DRD2DRD3POLBHSD17B10HTR7
SCHEMBL5658289 0.85 HTR1A (0.58) KCNH2DRD2DRD3HTR1ADRD4
SCHEMBL5656348 0.85 MEN1 (0.52) DRD2DRD3POLBHTR7MEN1
SCHEMBL5656018 0.84 KCNH2 (0.54) KCNH2DRD2DRD3HTR7MEN1

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-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 KCNH2 1144/4885DRD2 73/4885DRD3 115/4885

“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.