SCHEMBL1747243

SCHEMBL1747243

COC(=O)c1cccc(-c2c(C)cccc2C=O)c1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 9/20 0.63
ALDH1A1 P00352 3/20 0.55
HCRTR1 O43613 1/20 0.52
HCRTR2 O43614 1/20 0.52
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.47
IL2 P60568 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
TGFBR1 P36897 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
SCHEMBL26114637 0.82 CA12 (0.52) ERN1ALDH1A1CA12CA1CA2
SCHEMBL27379231 0.81 CA12 (0.51) ERN1ALDH1A1CA12CA1CA2
SCHEMBL1745570 0.80 CA12 (0.50) ERN1ALDH1A1CA12CA1CA2
SCHEMBL17507417 0.80 ERN1 (0.75) ERN1
SCHEMBL20530671 0.78 CA12 (0.48) ERN1ALDH1A1CA12CA1CA2
SCHEMBL67941 0.78 CA12 (0.68) ERN1CA12CA1CA2CA9
SCHEMBL6640776 0.77 ERN1 (1.00) ERN1HCRTR1HCRTR2CA12CA1
SCHEMBL3106966 0.77 ERN1 (0.59) ERN1ALDH1A1HCRTR1HCRTR2CA12
SCHEMBL1746795 0.77 CA12 (0.47) ERN1CA12CA1CA2CA9
SCHEMBL8846045 0.77 ERN1 (0.54) ERN1ALDH1A1

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 5 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-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 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 (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-20090012093-A1 Receptor Function Regulator GPR119, GIPR, INSR ERN1 2154/4885ALDH1A1 4258/4885HCRTR1 190/4885

“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.