SCHEMBL6714902

SCHEMBL6714902

CCCCC(C)(Cc1ccc(OCCN)cc1)C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.44
PPARD Q03181 3/20 0.44
PPARG P37231 1/20 0.44
S1PR1 P21453 4/20 0.44
S1PR4 O95977 3/20 0.44
S1PR3 Q99500 3/20 0.44
S1PR5 Q9H228 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
PDE4A P27815 1/20 0.41
HIF1A Q16665 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL6715300 0.89 PPARA (0.45) PPARAPPARDPPARGS1PR1S1PR4
SCHEMBL6715834 0.88 PPARG (0.47) PPARAPPARDPPARGS1PR1S1PR4
SCHEMBL6717544 0.84 PPARA (0.46) PPARAPPARDPPARGS1PR1S1PR4
SCHEMBL6713635 0.82 L3MBTL1 (0.50) PPARAPPARDPPARGKDM4EALDH1A1
SCHEMBL6715271 0.81 ESR1 (0.44) PPARAPPARGSMN1; SMN2MAPK1KDM4E
SCHEMBL6715187 0.78 MEN1 (0.50) PPARAPPARDPPARGS1PR1S1PR4
SCHEMBL6715867 0.77 PPARG (0.48) PPARAPPARDPPARG
SCHEMBL6713621 0.75 PPARA (0.57) PPARAPPARDPPARG
SCHEMBL13628909 0.75 S1PR1 (0.59) S1PR1S1PR4S1PR3S1PR5SMN1; SMN2
SCHEMBL6713395 0.74 ALOX5 (0.52) PPARAPPARDPPARGKDM4EALDH1A1

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-20040006141-A1 Amidocarboxylic acid compounds SANKYO COMPANY, LTD (JP) 2004-01-08 US disclosed
US-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 US disclosed
CN-1280561-A Amidocarboxylic acid derivatives SANKYO CO (JP) 2001-01-17 CN disclosed
EP-1026149-A1 AMIDOCARBOXYLIC ACID DERIVATIVES Sankyo Company Limited (JP) 2000-08-09 EP 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 (1 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-20040006141-A1 Amidocarboxylic acid compounds NR1H2, AGK, APOL1 PPARA 71/4885PPARD 200/4885PPARG 23/4885

“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.