SCHEMBL6324801

SCHEMBL6324801

O=C(O)C(Cc1ccccc1)N(Cc1cccc(-c2cc3ccccc3o2)c1)C(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 2/20 0.45
TP53 P04637 1/20 0.39
ERAP1 Q9NZ08 2/20 0.39
FFAR1 O14842 1/20 0.38
BCHE P06276 1/20 0.38

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
SCHEMBL6324795 1.00 PSMB5 (0.45) PSMB5TP53ERAP1FFAR1BCHE
SCHEMBL6316090 0.93 MMP12 (0.43) ERAP1FFAR1BCHE
SCHEMBL6316097 0.93 MMP12 (0.43) ERAP1FFAR1BCHE
SCHEMBL6317113 0.91 PSMB5 (0.46) PSMB5TP53ERAP1FFAR1
SCHEMBL6316852 0.91 PSMB5 (0.44) PSMB5ERAP1
SCHEMBL6317119 0.91 PSMB5 (0.46) PSMB5TP53ERAP1FFAR1
SCHEMBL6316858 0.91 PSMB5 (0.44) PSMB5ERAP1
SCHEMBL6319773 0.89 MMP12 (0.41) ERAP1FFAR1
SCHEMBL6318724 0.89 MMP12 (0.41) ERAP1FFAR1
SCHEMBL6318487 0.88 PPARA (0.39)

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 PSMB5 2872/4885TP53 4354/4885ERAP1 418/4885

“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.