SCHEMBL4032477

SCHEMBL4032477

Cc1sc(-c2ccccc2)nc1COc1ccc(COc2ncccc2CC(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.45
PPARD Q03181 3/20 0.45
PPARG P37231 7/20 0.43
PPARA Q07869 6/20 0.43
NR1H4 Q96RI1 1/20 0.42
PRMT5 O14744 1/20 0.42
ROCK2 O75116 2/20 0.41
CYP2C9 P11712 1/20 0.41
KCNH2 Q12809 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PTGDR2 Q9Y5Y4 3/20 0.40
PTGER4 P35408 1/20 0.40

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
SCHEMBL4031214 0.89 MEN1 (0.43) FFAR1PPARDPPARGPPARAROCK2
SCHEMBL4030984 0.87 L3MBTL1 (0.47) FFAR1PPARDPPARGPPARANR1H4
SCHEMBL4037155 0.85 PDE4A (0.40) FFAR1PPARDPPARGPPARAPRMT5
SCHEMBL4035756 0.83 PPARA (0.37) PPARDPPARGPPARAROCK2CYP2C9
SCHEMBL4029418 0.82 FFAR1 (0.40) FFAR1PPARDPPARGPPARAROCK2
SCHEMBL4028802 0.82 FFAR1 (0.64) FFAR1PPARGPPARA
SCHEMBL4035460 0.81 FFAR1 (0.63) FFAR1PPARGPPARA
SCHEMBL4034640 0.80 HRH3 (0.43) FFAR1PPARDPPARGPPARAL3MBTL1
Water SCHEMBL4035926 0.80 FFAR1 (0.62) FFAR1PPARGPPARA
SCHEMBL4031561 0.77 PPARG (0.64) FFAR1PPARDPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1357115-B1 ALKANOIC ACID DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2009-06-17 EP disclosed
US-7238716-B2 Alkanoic acid derivatives process for their production and use thereof TAKEDA PHARMACEUTICALS COMPANY LIMITED (JP) 2007-07-03 US disclosed
US-20040058965-A1 Alkanoic acid derivatives process for their production and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-25 US disclosed
EP-1357115-A1 ALKANOIC ACID DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-10-29 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-20040058965-A1 Alkanoic acid derivatives process for their production and use thereof GPR119, ACOX1, ALK FFAR1 4/4885PPARD 754/4885PPARG 593/4885

“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.