SCHEMBL22434898

SCHEMBL22434898

CCCCCCCC(CCCC)n1cc(CC(N)C(=O)O)nn1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
CYP19A1 P11511 6/20 0.41
SLC1A2 P43004 2/20 0.40
SLC1A1 P43005 2/20 0.40
GRIA4 P48058 4/20 0.39
MEN1 O00255 1/20 0.38
PABPC1 P11940 1/20 0.38
KMT2A Q03164 1/20 0.38
GRIA1 P42261 3/20 0.38
GRIA2 P42262 3/20 0.38
GRIA3 P42263 3/20 0.38
SLC1A3 P43003 1/20 0.38
CYP1A2 P05177 2/20 0.37
RECQL P46063 1/20 0.36
GPR84 Q9NQS5 2/20 0.35

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
SCHEMBL18659740 0.99 GRIK1 (0.43) GRIK1GRIK2CYP19A1SLC1A2SLC1A1
SCHEMBL19505363 0.99 GRIK1 (0.43) GRIK1GRIK2CYP19A1SLC1A2SLC1A1
SCHEMBL20913893 0.79 EPHX2 (0.51) GRIA4
SCHEMBL20913891 0.79 EPHX2 (0.51) GRIA4
SCHEMBL23220476 0.79 EPHX2 (0.51) GRIA4
SCHEMBL17618924 0.77 CYP1A2 (0.45) GRIK1GRIA4GRIA1GRIA2GRIA3
SCHEMBL19412791 0.73 GRIA4 (0.37) GRIK1GRIK2CYP19A1SLC1A2SLC1A1
SCHEMBL10059442 0.72 GRIA4 (0.49) GRIK1GRIA4GRIA1GRIA2GRIA3
SCHEMBL19412792 0.72 GRIA4 (0.40) GRIK1GRIK2SLC1A2SLC1A1GRIA4
SCHEMBL10059980 0.71 GRIA4 (0.54) GRIK1GRIK2GRIA4GRIA1GRIA2

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-20200290982-A1 METAL/RADIOMETAL-LABELED PSMA INHIBITORS FOR PSMA-TARGETED IMAGING AND RADIOTHERAPY THE JOHNS HOPKINS UNIVERSTY 2020-09-17 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-20200290982-A1 METAL/RADIOMETAL-LABELED PSMA INHIBITORS FOR PSMA-TARGETED IMAGING AND RADIOTHERAPY PSMA6, PSMA1, UTS2R GRIK1 1138/4885GRIK2 2170/4885CYP19A1 4713/4885

“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.