SCHEMBL3487240

SCHEMBL3487240

O=C(O)N1CCC[C@@H](NCc2ccc(Cl)cc2)C1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
BCHE P06276 4/20 0.54
ACHE P22303 4/20 0.54
BACE1 P56817 4/20 0.54
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
EPHX1 P07099 1/20 0.48
DPP7 Q9UHL4 3/20 0.47
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPC1 O15118 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
CCR2 P41597 1/20 0.43
HDAC1 Q13547 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
SCHEMBL994595 0.88 ACHE (0.54) BCHEACHEBACE1KMT2AEPHX1
SCHEMBL2241661 0.88 ACHE (0.54) BCHEACHEBACE1KMT2AEPHX1
SCHEMBL20765861 0.87 BCHE (0.53) POLBBCHEACHEBACE1MEN1
SCHEMBL17604857 0.87 BCHE (0.53) POLBBCHEACHEBACE1MEN1
SCHEMBL20766009 0.87 BCHE (0.53) POLBBCHEACHEBACE1MEN1
SCHEMBL1562904 0.84 ACHE (0.52) BCHEACHEBACE1EPHX1DPP7
SCHEMBL19024503 0.83 BCHE (0.58) POLBBCHEACHEBACE1MEN1
SCHEMBL17141222 0.83 BCHE (0.58) POLBBCHEACHEBACE1MEN1
SCHEMBL13434283 0.82 HTT (0.51) POLBBCHEACHEBACE1MEN1
SCHEMBL14747175 0.82 HTT (0.51) POLBBCHEACHEBACE1MEN1

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-20100056497-A1 AMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2010-03-04 US disclosed
EP-2119702-A1 AMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2009-11-18 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-20100056497-A1 AMIDE DERIVATIVE REN, AGTR1, AGTR2 POLB 2569/4885BCHE 1015/4885ACHE 770/4885

“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.