SCHEMBL1998007

SCHEMBL1998007

CN(CCCOc1ccc2[nH]c(CC(=O)O)cc2c1)c1nc(-c2ccc(C(F)(F)F)cc2)ncc1F

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.49
PPARD Q03181 16/20 0.49
CACNA1H O95180 1/20 0.39
CACNA1B Q00975 1/20 0.39
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
PPARG P37231 1/20 0.37
FFAR1 O14842 1/20 0.36

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
SCHEMBL2006018 0.92 PPARD (0.51) PPARAPPARDPDGFRBPDGFRAFFAR1
SCHEMBL2004281 0.91 PPARD (0.51) PPARAPPARDBCHEACHEPDGFRB
SCHEMBL2006654 0.90 PPARD (0.61) PPARAPPARDPDGFRBPDGFRA
SCHEMBL2001957 0.85 PPARD (0.47) PPARAPPARDBCHEACHEPDGFRB
SCHEMBL2008024 0.85 PPARD (0.61) PPARAPPARDPDGFRBPDGFRAPPARG
SCHEMBL2003371 0.83 PPARD (0.42) PPARAPPARDPDGFRBPDGFRA
SCHEMBL1999969 0.82 PPARD (0.61) PPARAPPARDPDGFRBPDGFRA
SCHEMBL1998013 0.81 TRPV3 (0.42) PPARAPPARDCACNA1BPPARGFFAR1
SCHEMBL12568704 0.80 PPARD (0.53) PPARAPPARDPPARG
SCHEMBL2026484 0.78 PPARD (0.49) PPARAPPARDPDGFRBPDGFRA

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 PPARA 243/4885PPARD 452/4885CACNA1H 2204/4885
US-20060264486-A1 Indole acetic acid derivatives and their use as pharmaceutical agents IDO1, IDO2, AADAT PPARA 243/4885PPARD 452/4885CACNA1H 2204/4885

“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.