SCHEMBL6360225

SCHEMBL6360225

CCOC(=O)C(=Cc1cccc(CCNCCCCCCCC(=O)OC(C)(C)C)c1)OCC

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 6/20 0.41
EPHX2 P34913 1/20 0.36
HDAC8 Q9BY41 2/20 0.36
PPARA Q07869 4/20 0.35
PPARG P37231 2/20 0.35
CYP4Z1 Q86W10 1/20 0.35
ALDH1A1 P00352 1/20 0.34
NAMPT P43490 1/20 0.34
CYP2D6 P10635 1/20 0.34
KCNH2 Q12809 1/20 0.34
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL6747532 0.89 CYP4Z1 (0.41) LTA4HHDAC8CYP4Z1ALDH1A1NAMPT
SCHEMBL6746587 0.75 EPHX2 (0.34) LTA4HEPHX2HDAC8CYP4Z1ALDH1A1
SCHEMBL6361340 0.75 LTA4H (0.37) LTA4HHDAC8PPARAPPARGCYP2D6
SCHEMBL6360227 0.74 PPARA (0.42) EPHX2PPARAPPARGALDH1A1HDAC3
SCHEMBL6360224 0.74 PPARA (0.42) EPHX2PPARAPPARGALDH1A1HDAC3
SCHEMBL7863637 0.72 HDAC8 (0.39) LTA4HHDAC8CYP2D6KCNH2
SCHEMBL6744039 0.71 LTA4H (0.41) LTA4HEPHX2HDAC8CYP4Z1
SCHEMBL6746616 0.70 LTA4H (0.44) LTA4HHDAC8KCNH2HDAC3HDAC1
SCHEMBL6746546 0.70 LTA4H (0.44) LTA4HHDAC8PPARAPPARGHDAC3
SCHEMBL16747377 0.69 PPARA (0.53) LTA4HPPARAPPARGCYP4Z1ALDH1A1

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-20050075377-A1 PPAR compounds PFIZER INC 2005-04-07 US disclosed
EP-1372632-A1 PROLIFERATIVE ACTIVATOR RECEPTOR (PPAR) COMPOUNDS Pfizer Products Inc. (US) 2004-01-02 EP disclosed
US-20020169192-A1 PPAR compounds HAYWARD CHERYL M (US) 2002-11-14 US disclosed
WO-2002064130-A1 PROLIFERATIVE ACTIVATOR RECEPTOR (PPAR) COMPOUNDS PFIZER PRODUCTS INC. (US) 2002-08-22 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 (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-20020169192-A1 PPAR compounds PPARA, PPARG, PPARD LTA4H 848/4885EPHX2 3414/4885HDAC8 474/4885
US-20050075377-A1 PPAR compounds PPARA, PPARG, PPARD LTA4H 848/4885EPHX2 3414/4885HDAC8 474/4885

“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.