SCHEMBL6325609

SCHEMBL6325609

O=C(O)[C@H](Cc1ccccc1)N(Cc1cc(-c2ccncc2)cs1)C(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
ADAMTS5 Q9UNA0 2/20 0.39
KIF11 P52732 1/20 0.38
PPARA Q07869 1/20 0.38
SHMT1 P34896 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL6325614 1.00 KMT2A (0.39) KMT2AADAMTS5KIF11PPARASHMT1
SCHEMBL6322789 0.89 ADAMTS5 (0.39) KMT2AADAMTS5KIF11PPARA
SCHEMBL6322782 0.89 ADAMTS5 (0.39) KMT2AADAMTS5KIF11PPARA
SCHEMBL6325714 0.89 SHMT1 (0.42) ADAMTS5PPARASHMT1
SCHEMBL6325708 0.89 SHMT1 (0.42) ADAMTS5PPARASHMT1
SCHEMBL6324643 0.88 PPARA (0.37) ADAMTS5KIF11PPARA
SCHEMBL6324648 0.88 PPARA (0.37) ADAMTS5KIF11PPARA
SCHEMBL6316622 0.87 ADAMTS5 (0.41) KMT2AADAMTS5PPARA
SCHEMBL6316626 0.87 ADAMTS5 (0.41) KMT2AADAMTS5PPARA
SCHEMBL6317567 0.87 ADAMTS5 (0.38) ADAMTS5KIF11PPARA

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 KMT2A 3263/4885ADAMTS5 1548/4885KIF11 2199/4885

“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.