SCHEMBL5012479

SCHEMBL5012479

CCCc1c(OCCCn2ccc3ccc(CC(=O)O)cc32)ccc2c(C(F)(F)F)noc12

nearest known ligand 0.88

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 14/20 0.88
NR1H3 Q13133 14/20 0.88
PPARD Q03181 14/20 0.88
PPARA Q07869 13/20 0.88
PPARG P37231 13/20 0.88

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
SCHEMBL5008698 0.94 PPARA (1.00) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL4234370 0.89 PPARA (0.88) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL5006697 0.89 PPARG (0.81) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL5336994 0.87 PPARD (0.77) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL5943621 0.87 PPARG (1.00) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL14465301 0.86 PPARG (0.86) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL5943590 0.86 NR1H3 (1.00) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL4237546 0.86 PPARG (0.74) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL14465303 0.85 NR1H3 (0.76) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL5943626 0.85 NR1H3 (0.78) NR1H2NR1H3PPARDPPARAPPARG

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-7449478-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-11-11 US disclosed
US-7449478-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-11-11 US disclosed
US-7449478-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-11-11 US disclosed
US-20050124675-A1 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-06-09 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-20050124675-A1 Indole compounds PPARG, PPARD, PPARA NR1H2 18/4885NR1H3 29/4885PPARD 2/4885

“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.