SCHEMBL4061237

SCHEMBL4061237

Cc1sc(-c2ccccc2)nc1COc1ccc(CCCC2OC(=O)NC2=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.45
FFAR1 O14842 3/20 0.41
PPARD Q03181 2/20 0.41
PPARA Q07869 10/20 0.40
ATP4A P20648 2/20 0.38
ATP4B P51164 2/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
CYP2C9 P11712 1/20 0.36
KCNH2 Q12809 1/20 0.36
NR1H4 Q96RI1 1/20 0.35
F2RL3 Q96RI0 1/20 0.35

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
SCHEMBL7025445 1.00 PPARG (0.45) PPARGFFAR1PPARDPPARAATP4A
SCHEMBL7028371 1.00 PPARG (0.45) PPARGFFAR1PPARDPPARAATP4A
SCHEMBL6584128 0.86 PPARG (0.62) PPARGPPARAF2RL3
SCHEMBL8794428 0.85 PPARG (0.41) PPARGFFAR1PPARDPPARAATP4A
SCHEMBL8794339 0.84 FFAR1 (0.60) PPARGFFAR1PPARDPPARA
SCHEMBL7024314 0.82 FFAR1 (0.41) PPARGFFAR1PPARDPPARAATP4A
SCHEMBL7162936 0.81 FFAR1 (0.59) PPARGFFAR1PPARDPPARA
SCHEMBL7164834 0.80 FFAR1 (0.58) PPARGFFAR1PPARDPPARA
SCHEMBL7025967 0.79 FFAR1 (0.45) PPARGFFAR1PPARDPPARAATP4A
SCHEMBL8795234 0.78 FFAR1 (0.62) PPARGFFAR1PPARDPPARA

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 13 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-7595333-B2 Agent for improving acidosis TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-29 US disclosed
EP-1093370-B1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF DIABETES TAKEDA PHARMACEUTICAL (JP) 2006-02-22 EP disclosed
US-20050239854-A1 Body weight gain inhibitors SUGIYAMA YASUO 2005-10-27 US disclosed
US-20040106649-A1 Agent for improving acidosis TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-06-03 US disclosed
US-20030134884-A1 Neovascularization inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-17 US disclosed
EP-1304121-A1 BODY WEIGHT GAIN INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-04-23 EP 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
US-20020086885-A1 Pharmaceutical composition TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2002-07-04 US 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 (5 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-20020086885-A1 Pharmaceutical composition GPR119, IAPP, PNLIP PPARG 86/4885FFAR1 96/4885PPARD 276/4885
US-20030060488-A1 Drug comprising combination TNF, HMGCR, TRAF6 PPARG 443/4885FFAR1 298/4885PPARD 540/4885
US-20050239854-A1 Body weight gain inhibitors PPARG, GPR119, PPARA PPARG 1/4885FFAR1 43/4885PPARD 5/4885
US-20040106649-A1 Agent for improving acidosis GPR119, SLC2A8, SLC2A1 PPARG 422/4885FFAR1 77/4885PPARD 872/4885
US-20030134884-A1 Neovascularization inhibitors VEGFA, FLT1, FLT4 PPARG 1641/4885FFAR1 3421/4885PPARD 2843/4885

“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.