SCHEMBL5753937

SCHEMBL5753937

O=C(NC(Cc1ccc(C(F)(F)F)cc1)C(O)c1ccc(F)cc1)c1ccc([C@@H]2O[C@@H]2c2ccc(Cl)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 2/20 0.43
CNR2 P34972 1/20 0.43
SLC6A9 P48067 1/20 0.40
SLC6A5 Q9Y345 1/20 0.40
CNR1 P21554 3/20 0.40
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
GCGR P47871 1/20 0.38
GIPR P48546 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CCR1 P32246 1/20 0.37

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
SCHEMBL5753931 1.00 UTS2R (0.43) UTS2RCNR2SLC6A9SLC6A5CNR1
SCHEMBL5751509 0.91 UTS2R (0.50) UTS2RCNR2SLC6A9SLC6A5CNR1
SCHEMBL5751037 0.88 UTS2R (0.47) UTS2RCNR2SLC6A9SLC6A5CNR1
SCHEMBL5751409 0.86 ALDH1A1 (0.48) UTS2RCNR2SLC6A9PPARGPPARA
SCHEMBL5752379 0.86 ALDH1A1 (0.48) UTS2RCNR2SLC6A9PPARGPPARA
SCHEMBL5751934 0.86 CNR2 (0.47) UTS2RCNR2SLC6A9SLC6A5CNR1
SCHEMBL5753512 0.86 NOS2 (0.47) UTS2RCNR2SLC6A9SLC6A5CNR1
SCHEMBL5753521 0.86 NOS2 (0.47) UTS2RCNR2SLC6A9SLC6A5CNR1
SCHEMBL5752315 0.83 CNR2 (0.45) CNR2SLC6A9ALDH1A1LMNA
SCHEMBL5752099 0.83 VNN1 (0.49) UTS2RSLC6A9PPARGPPARAALDH1A1

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 UTS2R 1794/4885CNR2 485/4885SLC6A9 1438/4885

“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.