SCHEMBL6323216

SCHEMBL6323216

O=C(O)C(Cc1ccccc1)N(Cc1ccc(-c2nccs2)o1)C(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.37
SHMT1 P34896 1/20 0.36
PPARA Q07869 1/20 0.36
TP53 P04637 1/20 0.36
SCD O00767 1/20 0.36
SCD5 Q86SK9 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 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
SCHEMBL6323213 1.00 KIF11 (0.37) KIF11SHMT1PPARATP53SCD
SCHEMBL6320113 0.87 TRPM4 (0.40) KIF11SHMT1
SCHEMBL6317252 0.87 TRPM4 (0.40) KIF11SHMT1
SCHEMBL6324992 0.86 LDHA (0.39) PPARATP53KDM4EALDH1A1HPGD
SCHEMBL6324989 0.86 LDHA (0.39) PPARATP53KDM4EALDH1A1HPGD
SCHEMBL6318448 0.85 KIF11 (0.39) KIF11SHMT1PPARA
SCHEMBL6317248 0.85 KIF11 (0.39) KIF11SHMT1PPARA
SCHEMBL6317480 0.85 PPARA (0.43) SHMT1PPARAKDM4EMEN1NPC1
SCHEMBL6317474 0.85 PPARA (0.43) SHMT1PPARAKDM4EMEN1NPC1
SCHEMBL6325311 0.84 TP53 (0.46) PPARATP53

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 4 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 claimed
US-20030229053-A1 Compounds and methods for the treatment or prevention of flavivirus infections SHIRE BIOCHEM INC. (CA) 2003-12-11 US claimed
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 2199/4885SHMT1 2213/4885PPARA 2311/4885

“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.