SCHEMBL5598110

SCHEMBL5598110

COc1ccc(OC(F)(F)F)cc1CNC(=O)CCl

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.50
PPARD Q03181 1/20 0.50
PPARA Q07869 1/20 0.50
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
ALDH1A1 P00352 2/20 0.46
CSNK1D P48730 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
TACR1 P25103 5/20 0.46
LMNA P02545 1/20 0.44
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
CYP2D6 P10635 1/20 0.44
KCNH2 Q12809 1/20 0.44

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
SCHEMBL21993472 0.81 PPARG (0.49) PPARGPPARDPPARACSNK1DTACR1
SCHEMBL5597754 0.81 CA1 (0.55) CA1CA2CA7CA9ALDH1A1
SCHEMBL5597867 0.81 TRPV1 (0.46) CA1CA2CA7ALDH1A1HTT
SCHEMBL6541429 0.79 TACR1 (0.46) PPARGPPARDPPARACSNK1DTACR1
SCHEMBL15118586 0.78 KCNH2 (0.50) TACR1CYP2D6KCNH2
SCHEMBL3205585 0.78 HCRTR1 (0.46) TACR1CYP2D6KCNH2
Hydrochloric Acid SCHEMBL6541423 0.78 TACR1 (0.48) PPARGPPARDPPARACSNK1DTACR1
SCHEMBL22220774 0.76 HCRTR1 (0.49) PPARGPPARDPPARATACR1CYP2D6
SCHEMBL25960220 0.76 PPARD (0.45) PPARGPPARDPPARACNR1TACR1
SCHEMBL2223385 0.76 ALDH1A1 (0.59) CA1CA2CA7CA9ALDH1A1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1815860-A2 Phosphate transport inhibitors GENZYME CORPORATION (US) 2007-08-08 EP disclosed
EP-1465638-B1 PHOSPHATE TRANSPORT INHIBITORS GENZYME CORP (US) 2007-05-16 EP disclosed
US-20070021509-A1 Phosphate transport inhibitors JOZEFIAK THOMAS H 2007-01-25 US disclosed
US-7119120-B2 Phosphate transport inhibitors GENZYME CORPORATION (US) 2006-10-10 US disclosed
EP-1465638-A2 PHOSPHATE TRANSPORT INHIBITORS GENZYME CORPORATION (US) 2004-10-13 EP disclosed
US-20040019113-A1 Phosphate transport inhibitors GELTEX PHARMACEUTICALS, INC. 2004-01-29 US disclosed
WO-2003057225-A2 PHOSPHATE TRANSPORT INHIBITORS GENZYME CORPORATION (US) 2003-07-17 WO 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 (2 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-20040019113-A1 Phosphate transport inhibitors SLC34A1, SLC34A2, SLC20A1 PPARG 2470/4885PPARD 3191/4885PPARA 3042/4885
US-20070021509-A1 Phosphate transport inhibitors SLC34A2, SLC34A1, SLC20A1 PPARG 3190/4885PPARD 3726/4885PPARA 3757/4885

“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.