SCHEMBL5755755

SCHEMBL5755755

CCOC(=O)C(Cc1ccc(C(F)(F)F)cc1)C(O)c1ccc(Cl)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.43
EPHX2 P34913 1/20 0.43
GRM4 Q14833 1/20 0.42
POLB P06746 2/20 0.41
FFAR2 O15552 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 1/20 0.40
GAA P10253 1/20 0.40
MAOB P27338 1/20 0.40
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
KCNE1 P15382 1/20 0.40
KCNQ1 P51787 1/20 0.40
FFAR1 O14842 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38

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
SCHEMBL5754503 0.85 FFAR2 (0.44) PPARGEPHX2GRM4FFAR2KCNQ3
SCHEMBL5752376 0.82 PPARG (0.47) PPARGEPHX2POLBKCNQ3KCNQ2
SCHEMBL5751854 0.79 PPARG (0.43) PPARGEPHX2POLBCYP1A2CYP3A4
SCHEMBL5752344 0.78 FFAR2 (0.46) PPARGGRM4FFAR2KCNQ3KCNQ2
SCHEMBL5749823 0.77 MEN1 (0.48) PPARGEPHX2FFAR1KMT2AMEN1
SCHEMBL5752346 0.77 GRM4 (0.51) PPARGEPHX2GRM4POLBFFAR2
SCHEMBL5752395 0.77 FFAR2 (0.41) PPARGGRM4FFAR2CYP3A4KCNQ3
SCHEMBL5749557 0.75 FFAR2 (0.42) PPARGGRM4FFAR2KCNQ3KCNQ2
SCHEMBL7125123 0.73 SMN1; SMN2 (0.45) PPARGEPHX2RECQLKMT2AMEN1
SCHEMBL1509083 0.72 DGAT1 (0.50) POLBCYP1A2CYP3A4CYP2C19KMT2A

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-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

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 PPARG 905/4885EPHX2 1434/4885GRM4 3172/4885

“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.