SCHEMBL8178901

SCHEMBL8178901

O=C(O)Cc1cn(Cc2ccc(Oc3ccccc3Cl)cc2)c2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.60
▸ LMNA P02545 1/20 0.60
▸ CXCL8 P10145 1/20 0.51
▸ PPARD Q03181 4/20 0.50
▸ PPARG P37231 3/20 0.50
▸ PPARA Q07869 3/20 0.50
▸ MCL1 Q07820 4/20 0.49
▸ ICMT O60725 2/20 0.49
▸ PLA2G2A P14555 1/20 0.47
▸ CDC25A P30304 1/20 0.46
▸ CHRM1 P11229 1/20 0.46
▸ HDAC1 Q13547 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.46
▸ CAMK2A Q9UQM7 1/20 0.46

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
SCHEMBL8179889 0.93 LMNA (0.60) ALDH1A1LMNAPPARDPPARGPPARA
SCHEMBL8181593 0.89 LMNA (0.65) ALDH1A1LMNAPPARDPPARGPPARA
SCHEMBL8175344 0.89 LMNA (0.65) ALDH1A1LMNAPPARDPPARGPPARA
SCHEMBL8172745 0.89 LMNA (0.68) ALDH1A1LMNACXCL8PPARDPPARG
SCHEMBL13931026 0.88 ALDH1A1 (0.65) ALDH1A1LMNAPPARDPPARGPPARA
SCHEMBL8178250 0.88 ALDH1A1 (0.56) ALDH1A1LMNAPPARDPPARGPPARA
SCHEMBL13931411 0.88 ALDH1A1 (0.56) ALDH1A1LMNACXCL8PPARDPPARG
SCHEMBL8178907 0.88 ALDH1A1 (0.56) ALDH1A1LMNAPPARDPPARGPPARA
SCHEMBL8178903 0.87 ALDH1A1 (0.67) ALDH1A1LMNAPPARDPPARGPPARA
SCHEMBL8180730 0.86 ALDH1A1 (0.60) ALDH1A1LMNAPPARDPPARGPPARA

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 2969/4885CXCL8 805/4885

“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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