SCHEMBL24433802

SCHEMBL24433802

CC(C)(C)C(=O)N[C@@H](CN)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.35
CNR2 P34972 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.30
POLB P06746 1/20 0.30
MAPK1 P28482 1/20 0.30
ECE1 P42892 1/20 0.30

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
SCHEMBL26781561 0.83 TGFBR1 (0.39) GRIA1CNR2NPSR1L3MBTL1POLB
SCHEMBL7353645 0.82 ECE1 (0.46) GRIA1CNR2NPSR1ECE1
SCHEMBL7349775 0.82 ECE1 (0.46) GRIA1CNR2NPSR1ECE1
SCHEMBL10223263 0.80 ALDH1A1 (0.41) CNR2
SCHEMBL24824249 0.80 HPGDS (0.42) GRIA1
SCHEMBL8023218 0.77 NPSR1 (0.33) CNR2NPSR1
SCHEMBL13990408 0.76 GRIA1 (0.39) GRIA1
SCHEMBL16237277 0.76 ALOX15 (0.45) ECE1
SCHEMBL26206773 0.75 CTSK (0.46)
SCHEMBL25590141 0.74 CNR2 (0.35) GRIA1CNR2NPSR1L3MBTL1POLB

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-20220155287-A1 SMALL MOLECULES TARGETING THE INTRINSICALLY DISORDERED STRUCTURAL ENSEMBLE OF ALPHA-SYNUCLEIN PROTECT AGAINST DIVERSE ALPHA-SYNUCLEIN MEDIATED DYSFUNCTIONS UNIV CALIFORNIA (US) 2022-05-19 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-20220155287-A1 SMALL MOLECULES TARGETING THE INTRINSICALLY DISORDERED STRUCTURAL ENSEMBLE OF ALPHA-SYNUCLEIN PROTECT AGAINST DIVERSE ALPHA-SYNUCLEIN MEDIATED DYSFUNCTIONS SNCA, PARK7, SYNCRIP GRIA1 2061/4885CNR2 4040/4885NPSR1 2644/4885

“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.