SCHEMBL2003264

SCHEMBL2003264

Cc1ccc(OCCOc2ccc3c(ccn3C(C)C(=O)O)c2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.47
KDM4E B2RXH2 1/20 0.44
MCL1 Q07820 6/20 0.41
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
BCL2 P10415 2/20 0.38
MEN1 O00255 2/20 0.38
MAPK1 P28482 2/20 0.38
KMT2A Q03164 2/20 0.38
TP53 P04637 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
RAB9A P51151 2/20 0.37
HPGD P15428 2/20 0.37
ITGB3 P05106 1/20 0.37
ITGAV P06756 1/20 0.37
NPC1 O15118 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL2001227 0.91 NPSR1 (0.47) PPARGKDM4EMCL1PPARDPPARA
SCHEMBL2000849 0.90 PPARA (0.42) PPARGMCL1PPARDPPARAMRGPRX4
SCHEMBL2000968 0.90 KDM4E (0.45) PPARGKDM4EPPARDMEN1MAPK1
SCHEMBL1998860 0.87 PPARD (0.47) PPARGKDM4EPPARDPPARAHTT
SCHEMBL1999623 0.79 PPARG (0.42) PPARGPPARDPPARAKMT2AITGB3
SCHEMBL2001015 0.79 PPARG (0.42) PPARGPPARDPPARAKMT2AITGB3
SCHEMBL1998869 0.79 PPARG (0.42) PPARGPPARDPPARAKMT2AITGB3
SCHEMBL2000563 0.78 ITGB3 (0.44) PPARGMCL1PPARDPPARABCL2
SCHEMBL1997202 0.78 PPARD (0.46) PPARGKDM4EPPARDPPARAKMT2A
SCHEMBL1998775 0.77 NPC1 (0.44) PPARGPPARDPPARAKMT2ATP53

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 10 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-7964622-B2 Indole acetic acid derivatives and their use as pharmaceutical agents BAYER HEALTHCARE LLC (US) 2011-06-21 US disclosed
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-20090298854-A1 Indole acetic acid derivatives and their use as pharmaceutical agents MA XIN 2009-12-03 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-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-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 PPARG 347/4885KDM4E 1373/4885MCL1 2673/4885
US-20060264486-A1 Indole acetic acid derivatives and their use as pharmaceutical agents IDO1, IDO2, AADAT PPARG 347/4885KDM4E 1373/4885MCL1 2673/4885

“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.