SCHEMBL6339665

SCHEMBL6339665

CC1=C(C(=O)OCc2ccccc2)C(c2cccc(Cl)c2)N(C(=O)Oc2ccc([N+](=O)[O-])cc2)C(=O)N1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CACNA1F O60840 10/20 0.59
CACNA1D Q01668 10/20 0.59
CACNA1S Q13698 10/20 0.59
CACNA1C Q13936 10/20 0.59
PDE1C Q14123 2/20 0.54
ATM Q13315 1/20 0.47
CACNA1B Q00975 1/20 0.46

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
SCHEMBL6347405 0.85 CACNA1F (0.67) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C
SCHEMBL6337588 0.84 CACNA1F (0.47) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C
SCHEMBL6346164 0.81 PDE1C (0.62) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C
SCHEMBL6339672 0.76 PDE1C (0.52) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C
SCHEMBL6337709 0.76 ADRA1D (0.60) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C
SCHEMBL6347834 0.76 ADRA1D (0.60) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C
SCHEMBL6339673 0.76 ADRA1D (0.56) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C
SCHEMBL6339676 0.76 PDE1C (0.51) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C
SCHEMBL6338169 0.76 ADRA1D (0.56) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C
SCHEMBL6338173 0.76 PDE1C (0.53) CACNA1FCACNA1DCACNA1SCACNA1CPDE1C

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.