SCHEMBL1633604

SCHEMBL1633604

O=C(O)CCc1ccc(OCc2ccc(CN(CCc3ncc4ccccn34)c3ccccc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.51
FFAR4 Q5NUL3 6/20 0.51
AKR1B1 P15121 3/20 0.43
PPARD Q03181 2/20 0.42
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL1745516 0.80 FFAR1 (0.76) FFAR1FFAR4AKR1B1POLBTDP1
SCHEMBL1745418 0.79 FFAR1 (0.64) FFAR1FFAR4AKR1B1
SCHEMBL1746738 0.77 FFAR1 (0.61) FFAR1FFAR4AKR1B1PPARD
SCHEMBL1747255 0.76 FFAR1 (0.60) FFAR1FFAR4AKR1B1PPARD
SCHEMBL1746777 0.76 FFAR1 (0.60) FFAR1FFAR4AKR1B1POLBTDP1
SCHEMBL1746788 0.74 FFAR1 (0.70) FFAR1FFAR4AKR1B1POLBTDP1
SCHEMBL1633608 0.71 FFAR1 (0.83) FFAR1FFAR4AKR1B1POLBTDP1
Benzyloxyphenylpropanoic Acid SCHEMBL1134648 0.71 FFAR1 (1.00) FFAR1FFAR4AKR1B1POLBTDP1
SCHEMBL1744939 0.71 FFAR1 (1.00) FFAR1FFAR4AKR1B1POLBTDP1
SCHEMBL15679202 0.71 FFAR1 (0.57) FFAR1FFAR4AKR1B1PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1559422-B1 RECEPTOR FUNCTION CONTROLLING AGENT TAKEDA PHARMACEUTICAL (JP) 2014-04-30 EP disclosed
EP-2385032-A1 GPR40 Receptor function regulator Takeda Pharmaceutical Company Limited (JP) 2011-11-09 EP disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed
US-7932289-B2 Remedy for diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-04-26 US disclosed
US-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 US disclosed
US-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 US disclosed
US-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 US disclosed
US-20080319077-A1 Remedy for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED 2008-12-25 US disclosed
EP-1559422-A1 RECEPTOR FUNCTION CONTROLLING AGENT Takeda Pharmaceutical Company Limited (JP) 2005-08-03 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 (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-20080319077-A1 Remedy for Diabetes GPR119, GLP1R, GPR65 FFAR1 19/4885FFAR4 22/4885AKR1B1 2009/4885
US-20090012093-A1 Receptor Function Regulator GPR119, GIPR, INSR FFAR1 33/4885FFAR4 44/4885AKR1B1 1186/4885

“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.