SCHEMBL4253002

SCHEMBL4253002

N#Cc1cccc(C(=O)Nc2c(C(N)=O)oc3c(F)cc(F)cc23)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
MAPK10 P53779 2/20 0.45
HSD17B10 Q99714 2/20 0.45
MEN1 O00255 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 2/20 0.45
TP53 P04637 1/20 0.45
AHR P35869 1/20 0.45
ABCC9 O60706 1/20 0.44
ABCC8 Q09428 1/20 0.44
KCNJ11 Q14654 1/20 0.44
KCNJ8 Q15842 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GRM5 P41594 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL13699698 0.87 TP53 (0.50) TSHRMAPK10HSD17B10MEN1HPGD
SCHEMBL13699770 0.84 TSHR (0.55) TSHRMAPK10HSD17B10MEN1HPGD
SCHEMBL13699926 0.84 TSHR (0.66) TSHRMAPK10HSD17B10MEN1HPGD
SCHEMBL13699897 0.82 MAPK10 (0.45) TSHRMAPK10HSD17B10MEN1HPGD
SCHEMBL13699861 0.81 MAPT (0.62) TSHRMAPK10HSD17B10MEN1HPGD
SCHEMBL13699906 0.79 TSHR (0.48) TSHRMAPK10HSD17B10MEN1HPGD
SCHEMBL13699711 0.78 TP53 (0.53) TSHRMAPK10HSD17B10MEN1HPGD
SCHEMBL13700196 0.77 MAPK10 (0.41) TSHRMAPK10HSD17B10MEN1HPGD
SCHEMBL4253013 0.77 MAPT (0.42) TSHRMAPK10HSD17B10MEN1HPGD
SCHEMBL13700163 0.77 MAPK10 (0.44) TSHRMAPK10HSD17B10MEN1HPGD

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
US-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-09-24 US disclosed
US-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-09-24 US disclosed
US-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-09-24 US disclosed
EP-1710233-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE Kissei Pharmaceutical Co., Ltd. (JP) 2006-10-11 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-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE ADORA2A, ADORA2B, HTR1F TSHR 231/4885MAPK10 3802/4885HSD17B10 1250/4885

“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.