SCHEMBL2004281

SCHEMBL2004281

COc1ccc(-c2ncc(F)c(N(C)CCCOc3ccc4[nH]c(CC(=O)O)cc4c3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 15/20 0.51
PPARA Q07869 15/20 0.51
FLT3 P36888 1/20 0.40
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
BCHE P06276 3/20 0.38
ACHE P22303 3/20 0.38

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
SCHEMBL2006654 0.92 PPARD (0.61) PPARDPPARAPDGFRBPDGFRA
SCHEMBL1998007 0.91 PPARA (0.49) PPARDPPARAPDGFRBPDGFRABCHE
SCHEMBL2006018 0.91 PPARD (0.51) PPARDPPARAPDGFRBPDGFRA
SCHEMBL2001957 0.87 PPARD (0.47) PPARDPPARAPDGFRBPDGFRABCHE
SCHEMBL2008024 0.87 PPARD (0.61) PPARDPPARAPDGFRBPDGFRA
SCHEMBL2003371 0.85 PPARD (0.42) PPARDPPARAFLT3PDGFRBPDGFRA
SCHEMBL2004363 0.85 PPARD (0.48) PPARDPPARAFLT3PDGFRBPDGFRA
SCHEMBL1999969 0.84 PPARD (0.61) PPARDPPARAPDGFRBPDGFRA
SCHEMBL2004288 0.81 MTNR1A (0.40) PPARDPPARA
SCHEMBL2010083 0.80 PPARG (0.53) PPARDPPARA

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-7964622-B2 Indole acetic acid derivatives and their use as pharmaceutical agents BAYER HEALTHCARE LLC (US) 2011-06-21 US disclosed
US-20090298854-A1 Indole acetic acid derivatives and their use as pharmaceutical agents MA XIN 2009-12-03 US disclosed
US-7592361-B2 (5-{3-[4-(4,5,6,7-tetrahydro-benzooxazol-2-yl)-phenoxy]-propoxy}-indol-1-yl)-acetic acid; diabetes, obesity, hyperlipidemia, and atherosclerotic disease BAYER PHARMACEUTICALS CORPORATION (US) 2009-09-22 US disclosed
US-20060264486-A1 Indole acetic acid derivatives and their use as pharmaceutical agents BAYER HEALTHCARE LLC 2006-11-23 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 (2 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-20090298854-A1 Indole acetic acid derivatives and their use as pharmaceutical agents IDO1, IDO2, AADAT PPARD 452/4885PPARA 243/4885FLT3 3086/4885
US-20060264486-A1 Indole acetic acid derivatives and their use as pharmaceutical agents IDO1, IDO2, AADAT PPARD 452/4885PPARA 243/4885FLT3 3086/4885

“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.