SCHEMBL8175259

SCHEMBL8175259

O=C(O)Cc1cn(Cc2cccc(OCc3ccccc3)c2)c2ccc(Br)cc12

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 4/20 0.66
PPARG P37231 3/20 0.66
PPARA Q07869 3/20 0.66
LTB4R Q15722 1/20 0.55
LTB4R2 Q9NPC1 1/20 0.55
ACHE P22303 1/20 0.54
BACE1 P56817 1/20 0.54
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
PLA2G2A P14555 6/20 0.52
ICMT O60725 4/20 0.52
MAOB P27338 1/20 0.47

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
SCHEMBL4257266 0.92 PPARD (0.69) PPARDPPARGPPARALTB4RLTB4R2
SCHEMBL13930965 0.92 PPARD (0.77) PPARDPPARGPPARALTB4RLTB4R2
SCHEMBL8179565 0.90 ICMT (0.58) PPARDPPARGPPARAALDH1A1LMNA
SCHEMBL8172515 0.88 LMNA (0.68) PPARDPPARGPPARALTB4RLTB4R2
SCHEMBL8178171 0.88 LMNA (0.57) PPARDPPARGPPARALTB4RLTB4R2
SCHEMBL8174606 0.88 PPARD (0.72) PPARDPPARGPPARALTB4RLTB4R2
SCHEMBL8174648 0.88 PLA2G2A (0.61) PPARDPPARGPPARAALDH1A1LMNA
SCHEMBL8173522 0.87 PPARD (0.54) PPARDPPARGPPARALTB4RLTB4R2
SCHEMBL8171659 0.87 PPARD (0.82) PPARDPPARGPPARALTB4RLTB4R2
SCHEMBL7679351 0.86 ALDH1A1 (0.62) PPARDPPARGPPARAALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2009-02-19 US disclosed
US-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2009-02-19 US disclosed
WO-2008100867-A2 NOVEL INHIBITORS HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2008-08-21 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-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION EIF2AK2, HAVCR2, HCCS PPARD 3946/4885PPARG 3213/4885PPARA 3718/4885

“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.