SCHEMBL6324097

SCHEMBL6324097

CC(C)(C)OC(=O)C(Cc1ccccc1)N(Cc1sccc1Br)C(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.37
TMEM97 Q5BJF2 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
PPARA Q07869 2/20 0.36

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
SCHEMBL6316940 0.88 PPARA (0.40) KIF11TMEM97SIGMAR1PPARA
SCHEMBL6316934 0.88 PPARA (0.40) KIF11TMEM97SIGMAR1PPARA
SCHEMBL6324953 0.87 KIF11 (0.35) KIF11TMEM97SIGMAR1
SCHEMBL6320486 0.78 SHMT1 (0.42) KIF11TMEM97SIGMAR1PPARA
SCHEMBL6318151 0.78 SHMT1 (0.42) KIF11TMEM97SIGMAR1PPARA
SCHEMBL6318122 0.78 CYP3A4 (0.40) TMEM97SIGMAR1PPARA
SCHEMBL6322294 0.77 L3MBTL1 (0.39) KIF11PPARA
SCHEMBL6322301 0.77 L3MBTL1 (0.39) KIF11PPARA
SCHEMBL6318056 0.76 KIF11 (0.37) KIF11PPARA
SCHEMBL6318059 0.76 KIF11 (0.37) KIF11PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887877-B2 Compounds and methods for the treatment or prevention of Flavivirus infections VIROCHEM PHARMA INC. (CA) 2005-05-03 US disclosed
US-20030229053-A1 Compounds and methods for the treatment or prevention of flavivirus infections SHIRE BIOCHEM INC. (CA) 2003-12-11 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-20030229053-A1 Compounds and methods for the treatment or prevention of flavivirus infections HAVCR2, ZC3HAV1, MAVS KIF11 2199/4885TMEM97 2467/4885SIGMAR1 2656/4885

“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.