SCHEMBL3732799

SCHEMBL3732799

O=C(O)C1CCC2CCCCCN21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.36
CNR1 P21554 3/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.33
HTT P42858 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
HPGD P15428 1/20 0.33
ACE P12821 1/20 0.33

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
SCHEMBL1979266 0.98 CNR2 (0.37) CNR2CNR1POLBGAAHTT
SCHEMBL11098876 0.94 CNR2 (0.40) CNR2CNR1POLBGAAL3MBTL1
SCHEMBL3710986 0.92 CNR2 (0.40) CNR2CNR1HTTALDH1A1ACE
SCHEMBL124448 0.92 ACE (0.37) ACE
SCHEMBL3710017 0.92 CNR2 (0.40) CNR2CNR1HTTALDH1A1ACE
SCHEMBL3718206 0.92 CNR2 (0.40) CNR2CNR1HTTALDH1A1ACE
SCHEMBL3718209 0.92 CNR2 (0.40) CNR2CNR1HTTALDH1A1ACE
SCHEMBL3180764 0.90 CNR2 (0.40) CNR2CNR1HTTALDH1A1ACE
SCHEMBL3720680 0.90 CNR2 (0.40) CNR2CNR1HTTALDH1A1ACE
SCHEMBL3720683 0.90 CNR2 (0.40) CNR2CNR1HTTALDH1A1ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100190688-A1 Tetrapeptide analogs IDUN PHARMACEUTICALS, INC. 2010-07-29 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-20100190688-A1 Tetrapeptide analogs TP53, PCNA, HRAS CNR2 4884/4885CNR1 4869/4885POLB 97/4885

“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.