SCHEMBL5750233

SCHEMBL5750233

O=C1NC(Cc2cccc(OC(F)(F)C(F)F)c2)C(c2cccc(F)n2)O1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CETP P11597 11/20 0.38
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
DAO P14920 2/20 0.35
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
PRKCA P17252 1/20 0.33
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
CCNB2 O95067 1/20 0.33
CCNE2 O96020 1/20 0.33
CDK1 P06493 1/20 0.33
FGFR1 P11362 1/20 0.33
CDK4 P11802 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNA2 P20248 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR4 P22455 1/20 0.33
FGFR3 P22607 1/20 0.33
CCND1 P24385 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
SCHEMBL5751660 0.83 CETP (0.44) CETPHCRTR1HCRTR2DAOPIM1
SCHEMBL5751465 0.83 CETP (0.37) CETPHCRTR1HCRTR2DAOPIM1
SCHEMBL5752122 0.83 CETP (0.37) CETPHCRTR1HCRTR2DAOABL1
SCHEMBL5752987 0.82 CETP (0.43) CETPHCRTR1HCRTR2DAO
SCHEMBL5753565 0.82 CETP (0.37) CETPHCRTR1HCRTR2DAOABL1
SCHEMBL5750260 0.81 CETP (0.39) CETPHCRTR1HCRTR2
SCHEMBL5754136 0.80 MDM2 (0.39) CETPHCRTR1HCRTR2DAOPIM1
SCHEMBL5751034 0.79 CETP (0.43) CETP
SCHEMBL5752451 0.79 CETP (0.37) CETPHCRTR1HCRTR2DAOPIM1
SCHEMBL5749786 0.79 CETP (0.37) CETPHCRTR1HCRTR2DAOPIM1

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 CETP 1/4885HCRTR1 1956/4885HCRTR2 1789/4885

“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.