SCHEMBL1746736

SCHEMBL1746736

COC(=O)CCc1cc(I)c(O)c(I)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PCNA P12004 4/20 0.44
TSHR P16473 2/20 0.43
HSP90AB1 P08238 1/20 0.43
ALOX5 P09917 4/20 0.42
TRPV1 Q8NER1 1/20 0.42
THRA P10827 2/20 0.41
THRB P10828 2/20 0.41
GAA P10253 2/20 0.41
ITGB3 P05106 1/20 0.41
ITGAV P06756 1/20 0.41
RXRA P19793 1/20 0.41
PPARG P37231 1/20 0.41
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
HIF1A Q16665 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 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
SCHEMBL22971866 0.85 ALOX5 (0.52) PCNAALOX5THRATHRBITGB3
SCHEMBL11886037 0.85 ALOX5 (0.46) PCNAALOX5THRATHRBITGB3
SCHEMBL1746504 0.83 ALOX5 (0.51) PCNAALOX5THRATHRBGAA
SCHEMBL30716575 0.83 ALOX5 (0.51) PCNAALOX5THRATHRBGAA
SCHEMBL15153012 0.82 ALOX5 (0.57) PCNAALOX5THRATHRBITGB3
SCHEMBL3866618 0.82 CYP4F2 (0.56) PCNAALOX5THRATHRBGAA
SCHEMBL5992538 0.81 PTGS1 (0.44) TSHRHSP90AB1ALOX5GAAKMT2A
SCHEMBL14485394 0.81 HSP90AB1 (0.66) PCNATSHRHSP90AB1ALOX5TRPV1
SCHEMBL5050130 0.81 HSP90AB1 (0.66) TSHRHSP90AB1ALOX5GAAKMT2A
SCHEMBL21100343 0.81 ALOX5 (0.49) PCNAALOX5TRPV1THRATHRB

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 6 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
CN-1735408-A Receptor function controlling agent TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-02-15 CN 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 PCNA 4849/4885TSHR 128/4885HSP90AB1 2333/4885

“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.