SCHEMBL1999284

SCHEMBL1999284

CCc1csc(-c2ccc(OCCCOc3ccc4[nH]cc([C@@H](C)C(=O)O)c4c3)nc2)n1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 14/20 0.55
PPARA Q07869 14/20 0.55
ENPP2 Q13822 1/20 0.40
HTT P42858 1/20 0.36
CDC25A P30304 1/20 0.36
CDC25B P30305 1/20 0.36
CDC25C P30307 1/20 0.36
DUSP3 P51452 1/20 0.36
CYP19A1 P11511 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35

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
SCHEMBL2002318 1.00 PPARD (0.55) PPARDPPARAENPP2HTTCDC25A
SCHEMBL2000355 1.00 PPARD (0.55) PPARDPPARAENPP2HTTCDC25A
SCHEMBL1998618 0.88 PPARD (0.56) PPARDPPARAENPP2
SCHEMBL2004770 0.85 PPARD (0.58) PPARDPPARAENPP2MTNR1AMTNR1B
SCHEMBL2002314 0.84 PPARD (0.56) PPARDPPARACDC25ACDC25BCDC25C
SCHEMBL2000353 0.84 PPARD (0.56) PPARDPPARACDC25ACDC25BCDC25C
SCHEMBL1999279 0.84 PPARD (0.56) PPARDPPARACDC25ACDC25BCDC25C
SCHEMBL1999967 0.83 PPARA (0.44) PPARDPPARAHTTMTNR1AMTNR1B
SCHEMBL2004039 0.82 PPARD (0.56) PPARDPPARAMTNR1AMTNR1B
SCHEMBL2000193 0.80 PPARD (0.52) PPARDPPARAHTTMEN1KMT2A

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 243/4885ENPP2 268/4885
US-20060264486-A1 Indole acetic acid derivatives and their use as pharmaceutical agents IDO1, IDO2, AADAT PPARD 452/4885PPARA 243/4885ENPP2 268/4885

“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.