SCHEMBL5749775

SCHEMBL5749775

CCOC(=O)C(Cc1cc(OC(F)(F)C(F)F)no1)C(=O)c1ccc(F)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.35
PPARG P37231 2/20 0.35
GAA P10253 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
RAB9A P51151 2/20 0.33
TSHR P16473 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
NPC1 O15118 1/20 0.33
MEN1 O00255 1/20 0.33
CASP3 P42574 1/20 0.33
KMT2A Q03164 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
PTPN1 P18031 1/20 0.33
ALDH1A1 P00352 4/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL5747760 0.80 EPHX2 (0.34) EPHX2PPARGGAAKDM4EMAPT
SCHEMBL5754407 0.78 PPARG (0.45) EPHX2PPARGTSHRMAPTMEN1
SCHEMBL5751822 0.77 EPHX2 (0.39) EPHX2PPARGTDP1SMN1; SMN2TSHR
SCHEMBL5749378 0.77 MDM2 (0.48) TDP1TSHRMAPTMEN1CASP3
SCHEMBL5749716 0.77 MDM2 (0.39) EPHX2PPARGTDP1TP53TSHR
SCHEMBL5753792 0.76 MDM2 (0.40) EPHX2PPARGMAPTMEN1CASP3
SCHEMBL5752434 0.75 EPHX2 (0.38) EPHX2PPARGGAAKDM4ETDP1
SCHEMBL5748807 0.73 EPHX2 (0.54) EPHX2PPARGKDM4EMAPTLMNA
SCHEMBL5750829 0.72 MDM2 (0.44) EPHX2PPARGTDP1TP53TSHR
SCHEMBL5753349 0.71 EPHX2 (0.54) EPHX2PPARGTP53SMN1; SMN2MAPT

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 EPHX2 1434/4885PPARG 905/4885GAA 3065/4885

“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.