SCHEMBL5209931

SCHEMBL5209931

CCOC(=O)C(C)Oc1ccc(C)c(C)c1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.67
SMN1; SMN2 Q16637 2/20 0.57
LMNA P02545 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KMT2A Q03164 1/20 0.54
ALDH2 P05091 1/20 0.46
EPHX2 P34913 2/20 0.46
POLB P06746 1/20 0.45
IDH1 O75874 1/20 0.45
KDM4E B2RXH2 1/20 0.44
FFAR1 O14842 1/20 0.43
MAPT P10636 2/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL22542311 0.87 LMNA (0.57) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL13744595 0.85 KMT2A (0.53) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL31274977 0.85 L3MBTL1 (0.52) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL2872775 0.85 L3MBTL1 (0.52) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL11711873 0.85 TDP1 (0.56) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL1927738 0.84 KMT2A (0.51) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL15447701 0.83 LMNA (0.60) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL3962442 0.83 LMNA (0.60) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL11548487 0.82 L3MBTL1 (0.63) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL9857703 0.82 LMNA (0.63) TDP1SMN1; SMN2LMNAL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313717-B1 OXAZOLYL-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS LILLY CO ELI (US) 2007-10-17 EP disclosed
US-7176224-B2 Oxazolyl-aryloxyacetic acid derivatives and their use as PPAR agonists ELI LILLY AND COMPANY (US) 2007-02-13 US disclosed
US-20040138277-A1 Oxazolyl-aryloxyacetic acid derivatives and their use as ppar agonists ELI LILLY AND COMPANY 2004-07-15 US disclosed
EP-1313717-A1 OXAZOLYL-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS ELI LILLY AND COMPANY (US) 2003-05-28 EP disclosed
WO-2002016332-A1 OXAZOLYL-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS ELI LILLY AND COMPANY (US) 2002-02-28 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-20040138277-A1 Oxazolyl-aryloxyacetic acid derivatives and their use as ppar agonists PPARA, PPARD, PPARG TDP1 3890/4885SMN1; SMN2 4393/4885LMNA 3917/4885

“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.