SCHEMBL6339945

SCHEMBL6339945

CC1=C(C(=O)O)C(c2cccc(Cl)c2)N(C(N)=O)C(=O)N1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CACNA1F O60840 1/20 0.50
CACNA1D Q01668 1/20 0.50
CACNA1S Q13698 1/20 0.50
CACNA1C Q13936 1/20 0.50
CACNA1B Q00975 12/20 0.45
HTT P42858 1/20 0.45
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 0.44
TP53 P04637 1/20 0.42
SLC9A1 P19634 1/20 0.42
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL10381256 1.00 CACNA1F (0.50) CACNA1FCACNA1DCACNA1SCACNA1CCACNA1B
SCHEMBL6338126 0.85 CACNA1F (0.67) CACNA1FCACNA1DCACNA1SCACNA1CCACNA1B
SCHEMBL6348280 0.84 CACNA1B (0.47) CACNA1FCACNA1DCACNA1SCACNA1CCACNA1B
SCHEMBL6346164 0.83 PDE1C (0.62) CACNA1FCACNA1DCACNA1SCACNA1CCACNA1B
SCHEMBL7267141 0.81 CACNA1F (0.63) CACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL9476049 0.81 CACNA1F (0.64) CACNA1FCACNA1DCACNA1SCACNA1CCACNA1B
SCHEMBL8330463 0.78 CACNA1F (0.43) CACNA1FCACNA1DCACNA1SCACNA1CADRA1D
SCHEMBL4503644 0.77 CACNA1B (0.65) CACNA1B
SCHEMBL6338003 0.77 ADRA1D (0.54) CACNA1FCACNA1DCACNA1SCACNA1CCACNA1B
SCHEMBL6348157 0.77 CACNA1F (0.48) CACNA1FCACNA1DCACNA1SCACNA1CCACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6855716-B2 Dihydropyrimidine compounds and compositions containing the same AJINOMOTO CO., INC. (JP) 2005-02-15 US disclosed
US-20020143023-A1 Dihydropyrimidine compounds and compositions containing the same AJINOMOTO CO. INC (JP) 2002-10-03 US disclosed
EP-1193259-A1 DIHYDROPYRIMIDINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2002-04-03 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-20020143023-A1 Dihydropyrimidine compounds and compositions containing the same CACNA1B, CACNA1D, CACNA1G CACNA1F 5/4885CACNA1D 2/4885CACNA1S 9/4885

“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.