SCHEMBL18946161

SCHEMBL18946161

CCOC(=O)C(Cc1ccc(CC(C(=O)OCC)C(=O)OCC)cc1)C(=O)OC

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.59
PTPRB P23467 1/20 0.58
PPARG P37231 7/20 0.51
PPARD Q03181 5/20 0.51
PPARA Q07869 4/20 0.51
ALDH1A1 P00352 1/20 0.49
TP53 P04637 1/20 0.49
LDHA P00338 1/20 0.49
NPY1R P25929 1/20 0.48
NPY2R P49146 1/20 0.48
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
PKM P14618 1/20 0.46
EPHX2 P34913 2/20 0.44
PTGS2 P35354 2/20 0.42

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
SCHEMBL1312803 0.92 MMP8 (0.62) MMP8PTPRBPPARGALDH1A1TP53
SCHEMBL6711568 0.87 MMP8 (0.57) MMP8PTPRBPPARGPPARAALDH1A1
SCHEMBL16327191 0.87 PTPRB (0.59) MMP8PTPRBPPARGPPARDPPARA
SCHEMBL9001515 0.87 MAPT (0.54) MMP8PTPRBALDH1A1PKM
SCHEMBL28332902 0.86 MMP8 (0.54) MMP8PTPRBPPARGALDH1A1ESR1
SCHEMBL490486 0.86 LDHA (0.69) MMP8PPARGPPARDPPARAALDH1A1
SCHEMBL5800254 0.85 MMP8 (0.55) MMP8ALDH1A1TP53LDHANPY1R
SCHEMBL20395698 0.84 PPARG (0.62) PTPRBPPARGPPARDPPARALDHA
SCHEMBL7436472 0.84 MMP8 (0.54) MMP8PPARGALDH1A1TP53LDHA
SCHEMBL27747 0.84 MMP8 (0.58) MMP8PTPRBALDH1A1TP53LDHA

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-20190218106-A1 EMM-28, A NOVEL SYNTHETIC CRYSTALLINE MATERIAL, ITS PREPARATION AND USE EXXONMOBIL RES & ENG CO (US) 2019-07-18 US disclosed
WO-2017095705-A1 EMM-28, A NOVEL SYNTHETIC CRYSTALLINE MATERIAL, ITS PREPARATION AND USE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2017-06-08 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-20190218106-A1 EMM-28, A NOVEL SYNTHETIC CRYSTALLINE MATERIAL, ITS PREPARATION AND USE CD14, ERG28, DAP3 MMP8 437/4885PTPRB 4067/4885PPARG 4187/4885

“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.