SCHEMBL6315768

SCHEMBL6315768

O=C(O)[C@H](Cc1ccccc1)N(Cc1cc(-c2cccc(F)c2)cs1)C(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.38
SCD5 Q86SK9 1/20 0.38
MDM2 Q00987 1/20 0.37
PPARG P37231 2/20 0.37
PPARA Q07869 2/20 0.37
SHMT1 P34896 1/20 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
SCHEMBL6315771 1.00 TP53 (0.38) TP53SCD5MDM2PPARGPPARA
SCHEMBL6324643 0.93 PPARA (0.37) PPARA
SCHEMBL6324648 0.93 PPARA (0.37) PPARA
SCHEMBL6317567 0.90 ADAMTS5 (0.38) PPARGPPARA
SCHEMBL6317572 0.90 ADAMTS5 (0.38) PPARGPPARA
SCHEMBL6317498 0.89 PPARA (0.39) PPARGPPARA
SCHEMBL6317493 0.89 PPARA (0.39) PPARGPPARA
SCHEMBL6322789 0.88 ADAMTS5 (0.39) PPARGPPARA
SCHEMBL6322782 0.88 ADAMTS5 (0.39) PPARGPPARA
SCHEMBL6322629 0.88 ACKR3 (0.40) TP53SCD5

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 6 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
EP-1395571-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS Shire Biochem Inc. (CA) 2004-03-10 EP disclosed
US-20030229053-A1 Compounds and methods for the treatment or prevention of flavivirus infections SHIRE BIOCHEM INC. (CA) 2003-12-11 US disclosed
WO-2002100846-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS SHIRE BIOCHEM INC. (CA) 2002-12-19 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 (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 TP53 4354/4885SCD5 3413/4885MDM2 4797/4885

“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.