SCHEMBL7024314

SCHEMBL7024314

Cc1sc(-c2ccccc2)nc1COc1ccc(CCCC2NC(=O)OC2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.41
PPARD Q03181 4/20 0.41
PPARG P37231 11/20 0.38
PPARA Q07869 10/20 0.38
CYP2C9 P11712 1/20 0.36
KCNH2 Q12809 1/20 0.36
ATP4A P20648 2/20 0.36
ATP4B P51164 2/20 0.36
NR1H4 Q96RI1 1/20 0.35
F2RL3 Q96RI0 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL8888384 0.86 PPARG (0.44) PPARGPPARAF2RL3
SCHEMBL8795247 0.85 MAPT (0.37) FFAR1PPARDATP4AATP4BNR1H4
SCHEMBL8794374 0.84 FFAR1 (0.60) FFAR1PPARDPPARGPPARA
SCHEMBL7028371 0.82 PPARG (0.45) FFAR1PPARDPPARGPPARACYP2C9
SCHEMBL4061237 0.82 PPARG (0.45) FFAR1PPARDPPARGPPARACYP2C9
SCHEMBL7025445 0.82 PPARG (0.45) FFAR1PPARDPPARGPPARACYP2C9
SCHEMBL7162944 0.81 FFAR1 (0.59) FFAR1PPARDPPARGPPARA
SCHEMBL7164840 0.80 FFAR1 (0.58) FFAR1PPARDPPARGPPARA
SCHEMBL7160623 0.80 FFAR1 (0.62) FFAR1PPARDPPARGPPARA
SCHEMBL7025967 0.79 FFAR1 (0.45) FFAR1PPARDPPARGPPARACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6147099-A USEFUL AS ANTI-DIABETICS OR HYPOLIPIDEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, INC. (JP) 2000-11-14 US claimed
US-20030134884-A1 Neovascularization inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-17 US disclosed
US-20030060488-A1 Drug comprising combination TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-03-27 US disclosed
EP-1277730-A1 NEOVASCULARIZATION INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-01-22 EP disclosed
EP-1254667-A1 DRUG COMPRISING COMBINATION Takeda Chemical Industries, Ltd. (JP) 2002-11-06 EP disclosed
JP-2001213880-A OPTICALLY ACTIVE OXAZOLIDINEDIONE COMPOUND TAKEDA CHEM IND LTD 2001-08-07 JP disclosed
JP-2000212174-A 2,4-OXAZOLIDINEDIONE DERIVATIVE, ITS PRODUCTION AND MEDICINAL COMPOSITION INCLUDING THE DERIVATIVE TAKEDA CHEM IND LTD 2000-08-02 JP disclosed
JP-2000191651-A 2,4-OXAZOLIDINEDIONE DERIVATIVE, ITS PRODUCTION AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TAKEDA CHEM IND LTD 2000-07-11 JP 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-20030060488-A1 Drug comprising combination TNF, HMGCR, TRAF6 FFAR1 298/4885PPARD 540/4885PPARG 443/4885
US-20030134884-A1 Neovascularization inhibitors VEGFA, FLT1, FLT4 FFAR1 3421/4885PPARD 2843/4885PPARG 1641/4885

“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.