SCHEMBL4735992

SCHEMBL4735992

C=C(C)NCc1ccc(OC(C)(C)C(=O)OCC)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 7/20 0.51
TSHR P16473 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PPARA Q07869 2/20 0.45
ABCB11 O95342 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
HTR2A P28223 1/20 0.45
PMP22 Q01453 1/20 0.45
GAA P10253 1/20 0.39
LMNA P02545 1/20 0.39
PPARG P37231 1/20 0.38
OPRK1 P41145 1/20 0.37

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
SCHEMBL5414174 0.88 FBP1 (0.49) FBP1TSHRPPARAABCB11CYP1A2
SCHEMBL4677347 0.86 FBP1 (0.55) FBP1TSHRSMN1; SMN2PPARAABCB11
SCHEMBL14445933 0.82 FBP1 (0.52) FBP1TSHRSMN1; SMN2PPARAABCB11
SCHEMBL4679282 0.82 FBP1 (0.51) FBP1TSHRSMN1; SMN2PPARAABCB11
SCHEMBL4678053 0.82 FBP1 (0.58) FBP1TSHRSMN1; SMN2PPARAABCB11
SCHEMBL14445931 0.81 FBP1 (0.50) FBP1TSHRSMN1; SMN2PPARAABCB11
SCHEMBL4682002 0.81 FBP1 (0.57) FBP1TSHRSMN1; SMN2PPARAABCB11
SCHEMBL4681433 0.81 PPARA (0.58) FBP1TSHRPPARAABCB11CYP1A2
SCHEMBL6740992 0.79 FBP1 (0.55) FBP1TSHRSMN1; SMN2PPARAABCB11
SCHEMBL4735996 0.79 LMNA (0.41) TSHRSMN1; SMN2PPARAGAALMNA

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 3 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-20050222424-A1 Phenyloxyalkanonic acid derivatives as hppar activators SMITHKLINE BEECHAM CORPORATION 2005-10-06 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 (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 393/4885TSHR 2419/4885SMN1; SMN2 3646/4885

“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.