SCHEMBL5752445

SCHEMBL5752445

CCOC(=O)C(Cc1ccc(C(C)(C)C)cc1)C(=O)c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.50
PPARG P37231 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 4/20 0.44
LMNA P02545 2/20 0.44
MDM2 Q00987 1/20 0.43
MMP8 P22894 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
TP53 P04637 1/20 0.41
NPC1 O15118 1/20 0.40
XBP1 P17861 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
PPARA Q07869 1/20 0.39
NR4A2 P43354 1/20 0.39
CASP3 P42574 1/20 0.39

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
SCHEMBL5750744 0.91 EPHX2 (0.49) EPHX2PPARGMEN1KMT2AMAPT
SCHEMBL5748807 0.91 EPHX2 (0.54) EPHX2PPARGMEN1KMT2AMAPT
SCHEMBL5751205 0.90 PPARG (0.54) EPHX2PPARGMAPTMDM2MMP8
SCHEMBL5751165 0.90 PPARG (0.54) EPHX2PPARGMAPTMDM2MMP8
SCHEMBL6377515 0.84 MMP8 (0.51) EPHX2PPARGSMN1; SMN2MEN1KMT2A
SCHEMBL5752926 0.84 LDHA (0.52) EPHX2PPARGKMT2ALMNAMDM2
SCHEMBL5752029 0.84 EPHX2 (0.48) EPHX2PPARGMEN1KMT2AMAPT
SCHEMBL5752702 0.84 EPHX2 (0.48) EPHX2PPARGMEN1KMT2AL3MBTL1
SCHEMBL5753349 0.83 EPHX2 (0.54) EPHX2PPARGSMN1; SMN2MEN1KMT2A
SCHEMBL5749307 0.81 NSD2 (0.49) EPHX2PPARGMDM2MMP8RAB9A

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 905/4885SMN1; SMN2 4771/4885

“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.