SCHEMBL6357777

SCHEMBL6357777

CCC(C)(Oc1cccc(CCN(CCc2ccc(F)cc2F)C(=O)CC2CCCCC2)c1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.46
PPARG P37231 11/20 0.46
PPARD Q03181 3/20 0.42
BCL9 O00512 1/20 0.41
CTNNB1 P35222 1/20 0.41
ADORA3 P0DMS8 1/20 0.38
RIPK1 Q13546 2/20 0.37
CYP2D6 P10635 1/20 0.35
MLNR O43193 1/20 0.34

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
SCHEMBL6359776 0.93 PPARA (0.46) PPARAPPARGPPARDBCL9CTNNB1
SCHEMBL6363524 0.85 PPARG (0.52) PPARAPPARGPPARDBCL9CTNNB1
SCHEMBL6362936 0.84 PPARA (0.52) PPARAPPARGCYP2D6
SCHEMBL6359444 0.83 PPARA (0.57) PPARAPPARGPPARDCYP2D6
SCHEMBL6357733 0.83 PPARG (0.49) PPARAPPARGPPARDBCL9CTNNB1
SCHEMBL7596460 0.83 PPARA (0.58) PPARAPPARGPPARDCYP2D6
SCHEMBL6358170 0.81 PPARG (0.49) PPARAPPARGPPARDBCL9CTNNB1
SCHEMBL6363205 0.81 PPARG (0.46) PPARAPPARGPPARDBCL9CTNNB1
SCHEMBL6363391 0.79 PPARA (0.60) PPARAPPARGPPARDCYP2D6
SCHEMBL6358999 0.78 PPARA (0.61) PPARAPPARGPPARDCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050075377-A1 PPAR compounds PFIZER INC 2005-04-07 US disclosed
US-20020169192-A1 PPAR compounds HAYWARD CHERYL M (US) 2002-11-14 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-20020169192-A1 PPAR compounds PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885PPARD 3/4885
US-20050075377-A1 PPAR compounds PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885PPARD 3/4885

“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.