SCHEMBL5752575

SCHEMBL5752575

CCOC(=O)C(Cc1cccc(Oc2ccccc2)c1)C(=O)c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 4/20 0.50
MMP8 P22894 1/20 0.45
CETP P11597 1/20 0.45
MAPK1 P28482 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TSHR P16473 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
CCR8 P51685 1/20 0.43
MME P08473 1/20 0.43
ACE P12821 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 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
SCHEMBL5750573 0.90 PPARG (0.53) MDM2MMP8CETPTDP1PPARG
SCHEMBL5753102 0.88 MDM2 (0.51) MDM2MMP8MAPK1L3MBTL1TSHR
SCHEMBL5754806 0.86 MDM2 (0.49) MDM2MMP8MAPK1L3MBTL1TSHR
SCHEMBL5753584 0.86 MDM2 (0.49) MDM2MMP8CETPMAPK1L3MBTL1
SCHEMBL9487640 0.86 MMP8 (0.56) MMP8MAPK1L3MBTL1TSHRTDP1
SCHEMBL5753775 0.84 MAPK14 (0.47) MMP8CETPMAPK1L3MBTL1TSHR
SCHEMBL5749378 0.84 MDM2 (0.48) MDM2CETPMAPK1L3MBTL1TSHR
SCHEMBL5750882 0.84 MDM2 (0.48) MDM2MMP8MAPK1L3MBTL1TSHR
SCHEMBL3573062 0.82 L3MBTL1 (0.52) MDM2MMP8MAPK1L3MBTL1TSHR
SCHEMBL5754069 0.82 MDM2 (0.47) MDM2MMP8MAPK1L3MBTL1TSHR

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
US-6982348-B2 Aminoethanol derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-03 US disclosed
US-20040127574-A1 Aminoethanol derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-07-01 US disclosed
EP-1362846-A1 AMINOETHANOL DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-11-19 EP 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-20040127574-A1 Aminoethanol derivatives CETP, LCAT, MTTP MDM2 3868/4885MMP8 3327/4885CETP 1/4885

“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.