SCHEMBL4682002

SCHEMBL4682002

CCOC(=O)C(C)(C)Oc1ccc(CBr)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 11/20 0.57
CYP4F2 P78329 1/20 0.52
CYP4A11 Q02928 1/20 0.52
PPARA Q07869 4/20 0.51
TSHR P16473 2/20 0.51
ABCB11 O95342 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
HTR2A P28223 1/20 0.51
PMP22 Q01453 1/20 0.51
PPARG P37231 2/20 0.42
OPRK1 P41145 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
ADRB3 P13945 1/20 0.38

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
SCHEMBL6740992 0.90 FBP1 (0.55) FBP1CYP4F2CYP4A11PPARATSHR
SCHEMBL4678053 0.88 FBP1 (0.58) FBP1PPARATSHRABCB11CYP1A2
SCHEMBL4681849 0.86 FBP1 (0.55) FBP1CYP4F2CYP4A11PPARATSHR
SCHEMBL4677347 0.85 FBP1 (0.55) FBP1PPARATSHRABCB11CYP1A2
SCHEMBL16585371 0.84 FBP1 (0.59) FBP1PPARATSHRABCB11CYP1A2
SCHEMBL581322 0.83 TSHR (0.64) FBP1PPARATSHRABCB11CYP1A2
SCHEMBL3585865 0.82 FBP1 (0.60) FBP1PPARATSHRABCB11CYP1A2
SCHEMBL6740635 0.82 FBP1 (0.55) FBP1PPARATSHRABCB11CYP1A2
SCHEMBL7980993 0.81 FBP1 (0.60) FBP1PPARATSHRABCB11CYP1A2
SCHEMBL4679282 0.81 FBP1 (0.51) FBP1PPARATSHRABCB11CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513796-B1 PHENYLOXYALKANOIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORP (US) 2008-02-13 EP disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-20050222424-A1 Phenyloxyalkanonic acid derivatives as hppar activators SMITHKLINE BEECHAM CORPORATION 2005-10-06 US disclosed
EP-1513796-A2 PHENYLOXYALKANOIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2005-03-16 EP disclosed
WO-2004000785-A2 PHENYLOXYALKANONIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-12-31 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 (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-20050222424-A1 Phenyloxyalkanonic acid derivatives as hppar activators CEL, HPN, LIPA FBP1 393/4885CYP4F2 601/4885CYP4A11 58/4885

“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.