SCHEMBL5752344

SCHEMBL5752344

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

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 3/20 0.46
KCNQ3 O43525 1/20 0.44
KCNQ2 O43526 1/20 0.44
KCNE1 P15382 1/20 0.44
KCNQ1 P51787 1/20 0.44
CNR2 P34972 3/20 0.42
GRM4 Q14833 1/20 0.41
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
CNR1 P21554 2/20 0.38
CCR9 P51686 1/20 0.38
AKR1C3 P42330 1/20 0.37
AKR1C2 P52895 1/20 0.37
UTS2R Q9UKP6 1/20 0.36
FPR2 P25090 1/20 0.36
HIF1A Q16665 1/20 0.36
EPAS1 Q99814 1/20 0.36
PTGER4 P35408 2/20 0.36

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
SCHEMBL5752418 0.86 FFAR2 (0.49) FFAR2CNR2UTS2R
SCHEMBL5754503 0.83 FFAR2 (0.44) FFAR2KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL5752076 0.81 NOS3 (0.44) CNR2PPARGPPARAFPR2
SCHEMBL6580474 0.81 NOS3 (0.44) CNR2PPARGPPARAFPR2
SCHEMBL5753617 0.81 FFAR2 (0.43) FFAR2CNR2PPARGPPARAFPR2
SCHEMBL5751737 0.81 MCHR1 (0.44) FFAR2KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL5752395 0.79 FFAR2 (0.41) FFAR2KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL5755755 0.78 PPARG (0.43) FFAR2KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL7117611 0.78 FFAR2 (0.42) FFAR2CNR2PPARGPPARACNR1
SCHEMBL5749557 0.77 FFAR2 (0.42) FFAR2KCNQ3KCNQ2KCNE1KCNQ1

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 FFAR2 184/4885KCNQ3 4557/4885KCNQ2 4417/4885

“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.