SCHEMBL6739024

SCHEMBL6739024

CCCN(CCC)C(C)Cl

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.39
KCNA5 P22460 1/20 0.30
KCNH2 Q12809 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
SCHEMBL7681925 0.82 MMP1 (0.33)
Hydrochloric Acid SCHEMBL11529391 0.80 DNM1 (0.35)
SCHEMBL7115358 0.75 FDPS (0.39) FDPSKCNA5KCNH2
SCHEMBL335809 0.73
SCHEMBL1686729 0.73 FDPS (0.42) FDPSKCNA5KCNH2
SCHEMBL17520206 0.73
Hydrochloric Acid SCHEMBL7371395 0.73 FDPS (0.37) FDPS
SCHEMBL28282786 0.73 MAPT (0.38)
Hydrochloric Acid SCHEMBL216404 0.71
SCHEMBL172247 0.71 FDPS (0.40) FDPSKCNA5KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127499-A1 Compounds, compositions and methods for preventing and treating pestivirus infection and associated diseases PEVEAR DANIEL C 2004-07-01 US disclosed
US-20030176431-A1 Compounds, compositions and methods for preventing and treating pestivirus infection and associated diseases PEVEAR DANIEL C 2003-09-18 US disclosed
EP-0921803-A4 METHODS FOR PREVENTING AND TREATING PESTIVIRUS INFECTION AND ASSOCIATED DISEASES VIROPHARMA INC (US) 2003-04-02 EP disclosed
US-6541472-B1 3-thio-5H-1,2,4-triazino(5,6-b) indole derivatives VIROPHARMA INCORPORATED 2003-04-01 US disclosed
EP-1056744-A1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES Aventis Pharmaceuticals Inc. (US) 2000-12-06 EP disclosed
WO-1999043675-A1 6,9-DISUBSTITUTED 2-[TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMACEUTICALS INC. (US) 1999-09-02 WO disclosed
EP-0921803-A1 METHODS FOR PREVENTING AND TREATING PESTIVIRUS INFECTION AND ASSOCIATED DISEASES Viropharma Incorporated (US) 1999-06-16 EP disclosed
US-5830894-A USING A TRIAZINOINDOLE COMPOUND VIROPHARMA INCORPORATED (US) 1998-11-03 US disclosed
WO-1998047899-A1 SUBSTITUTED PYRROLOPYRIDINES USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES ORTHO-MCNEIL CORPORATION, INC. (US) 1998-10-29 WO disclosed
WO-1998036752-A1 METHODS FOR PREVENTING AND TREATING PESTIVIRUS INFECTION AND ASSOCIATED DISEASES VIROPHARMA INCORPORATED (US) 1998-08-27 WO 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 (2 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-20030176431-A1 Compounds, compositions and methods for preventing and treating pestivirus infection and associated diseases ZC3HAV1, MAVS, HAVCR2 FDPS 58/4885KCNA5 1959/4885KCNH2 2336/4885
US-20040127499-A1 Compounds, compositions and methods for preventing and treating pestivirus infection and associated diseases ZC3HAV1, MAVS, HAVCR2 FDPS 58/4885KCNA5 1959/4885KCNH2 2336/4885

“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.