SCHEMBL5894002

SCHEMBL5894002

Fc1ccc(Cn2ccc3cc(OCc4ccccc4)ccc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.51
PPARD Q03181 2/20 0.50
PPARA Q07869 2/20 0.50
ALOX5 P09917 1/20 0.49
ROCK1 Q13464 1/20 0.48
NPC1 O15118 2/20 0.48
MEN1 O00255 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48
MAOB P27338 1/20 0.47
PPARG P37231 1/20 0.47
HSP90AA1 P07900 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
BCL2 P10415 1/20 0.45
MCL1 Q07820 1/20 0.45

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
SCHEMBL3193186 0.92 MAPK14 (0.61) MAPK14PPARDPPARAALOX5ROCK1
SCHEMBL6086123 0.89 MAPK14 (0.54) MAPK14PPARDPPARAALOX5ROCK1
SCHEMBL6100496 0.86 ALOX5 (0.61) MAPK14PPARDPPARAALOX5ROCK1
SCHEMBL9194734 0.85 ROCK1 (0.54) MAPK14PPARDPPARAALOX5ROCK1
SCHEMBL6098412 0.84 PPARD (0.49) MAPK14PPARDPPARAALOX5ROCK1
SCHEMBL3195439 0.83 PPARG (0.52) PPARDPPARANPC1MAOBPPARG
SCHEMBL2828419 0.82 FFAR1 (0.63) MAPK14PPARDPPARA
SCHEMBL6192092 0.81 HTR6 (0.59) MAPK14SMN1; SMN2ALOX5NPC1MEN1
SCHEMBL5894379 0.81 HDAC8 (0.56) MAOBPPARGHDAC3HDAC1HDAC2
SCHEMBL5734440 0.81 ROCK1 (0.58) PPARDPPARAALOX5ROCK1NPC1

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1325490-C Process for preparing high purity hydroxyindolylacetylglyoxylamides ELBION AG (DE) 2007-07-11 CN claimed
US-7122674-B2 Process for preparing high-purity hydroxyindolylglyoxylamides ELBION AG (DE) 2006-10-17 US claimed
CN-1671692-A Method for producing highly pure hydroxy indolyl glyoxylic acid amides ELBION AG (DE) 2005-09-21 CN claimed
EP-1525197-A1 METHOD FOR PRODUCING HIGHLY PURE HYDROXY INDOLYL GLYOXYLIC ACID AMIDES Elbion AG (DE) 2005-04-27 EP claimed
US-20040063939-A1 Process for preparing high-purity hydroxyindolylglyoxylamides ELBION AG (DE) 2004-04-01 US claimed
WO-2004013127-A1 METHOD FOR PRODUCING HIGHLY PURE HYDROXY INDOLYL GLYOXYLIC ACID AMIDES ELBION AG (DE) 2004-02-12 WO claimed
CN-1325490-C Process for preparing high purity hydroxyindolylacetylglyoxylamides ELBION AG (DE) 2007-07-11 CN disclosed
US-7129250-B2 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2006-10-31 US disclosed
US-7122674-B2 Process for preparing high-purity hydroxyindolylglyoxylamides ELBION AG (DE) 2006-10-17 US disclosed
CN-1671692-A Method for producing highly pure hydroxy indolyl glyoxylic acid amides ELBION AG (DE) 2005-09-21 CN disclosed
EP-1525197-A1 METHOD FOR PRODUCING HIGHLY PURE HYDROXY INDOLYL GLYOXYLIC ACID AMIDES Elbion AG (DE) 2005-04-27 EP disclosed
US-20040220202-A1 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2004-11-04 US disclosed
US-20040102467-A1 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2004-05-27 US disclosed
US-20040063939-A1 Process for preparing high-purity hydroxyindolylglyoxylamides ELBION AG (DE) 2004-04-01 US disclosed
WO-2004013127-A1 METHOD FOR PRODUCING HIGHLY PURE HYDROXY INDOLYL GLYOXYLIC ACID AMIDES ELBION AG (DE) 2004-02-12 WO disclosed
EP-1283836-A2 NEUROPROTECTIVE AND ANTI-PROLIFERATIVE COMPOUNDS Aegera Therapeutics Inc. (CA) 2003-02-19 EP disclosed
WO-2001087887-A2 NEUROPROTECTIVE AND ANTI-PROLIFERATIVE COMPOUNDS AEGERA THERAPEUTICS INC. (CA) 2001-11-22 WO 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 (3 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-20040063939-A1 Process for preparing high-purity hydroxyindolylglyoxylamides HAAO, HPD, GRHPR MAPK14 3858/4885SMN1; SMN2 4796/4885PPARD 4660/4885
US-20040220202-A1 Neuroprotective and anti-proliferative compounds NLN, MKI67, BDNF MAPK14 839/4885SMN1; SMN2 21/4885PPARD 526/4885
US-20040102467-A1 Neuroprotective and anti-proliferative compounds MKI67, NLN, BDNF MAPK14 824/4885SMN1; SMN2 22/4885PPARD 437/4885

“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.