SCHEMBL8188581

SCHEMBL8188581

COc1ccccc1Oc1cccc(Cn2cc(CC(=O)O)c3ccccc32)c1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.62
▸ LMNA P02545 1/20 0.62
▸ PPARG P37231 3/20 0.54
▸ PPARD Q03181 3/20 0.54
▸ PPARA Q07869 3/20 0.54
▸ PLA2G2A P14555 2/20 0.53
▸ ICMT O60725 5/20 0.53
▸ CCR8 P51685 2/20 0.50
▸ CHRNB2 P17787 2/20 0.49
▸ CHRNA7 P36544 2/20 0.49
▸ CHRNA4 P43681 2/20 0.49
▸ MCL1 Q07820 1/20 0.48
▸ MAPT P10636 1/20 0.48

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
SCHEMBL13931405 0.93 ALDH1A1 (0.59) ALDH1A1LMNAPPARGPPARDPPARA
SCHEMBL8173991 0.92 ALDH1A1 (0.58) ALDH1A1LMNAPPARGPPARDPPARA
SCHEMBL13931408 0.92 ALDH1A1 (0.58) ALDH1A1LMNAPPARGPPARDPPARA
SCHEMBL13931407 0.92 ALDH1A1 (0.60) ALDH1A1LMNAPPARGPPARDPPARA
SCHEMBL8173885 0.91 ALDH1A1 (0.57) ALDH1A1LMNAPPARGPPARDPPARA
SCHEMBL8171623 0.90 ALDH1A1 (0.64) ALDH1A1LMNAPPARGPPARDPPARA
SCHEMBL8165182 0.89 ALDH1A1 (0.63) ALDH1A1LMNAPPARGPPARDPPARA
SCHEMBL8178907 0.89 ALDH1A1 (0.56) ALDH1A1LMNAPPARGPPARDPPARA
SCHEMBL13931023 0.88 LMNA (0.71) ALDH1A1LMNAPPARGPPARDPPARA
SCHEMBL8181354 0.88 LMNA (0.62) ALDH1A1LMNAPPARGPPARDPPARA

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 ALDH1A1 1836/4885LMNA 2969/4885PPARG 3213/4885

“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.

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