SCHEMBL5094860

SCHEMBL5094860

COC(=O)c1cc(-c2ccc3c(c2)CCO3)n[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.47
▸ NPC1 O15118 4/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ MAPT P10636 7/20 0.45
▸ ALPL P05186 5/20 0.45
▸ KDM4E B2RXH2 2/20 0.43
▸ GSK3B P49841 1/20 0.42
▸ CLK1 P49759 1/20 0.42
▸ PRKAB2 O43741 1/20 0.41
▸ PRKAG1 P54619 1/20 0.41
▸ PRKAA2 P54646 1/20 0.41
▸ PRKAA1 Q13131 1/20 0.41
▸ PRKAG3 Q9UGI9 1/20 0.41
▸ PRKAG2 Q9UGJ0 1/20 0.41
▸ PRKAB1 Q9Y478 1/20 0.41
▸ NOTUM Q6P988 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ GAA P10253 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
SCHEMBL5094845 0.86 KDM4E (0.52) RAB9ANPC1SMN1; SMN2MAPTALPL
SCHEMBL7719886 0.77 MAPT (0.70) RAB9ANPC1SMN1; SMN2MAPTALPL
SCHEMBL1924210 0.76 ALPL (0.68) RAB9ANPC1SMN1; SMN2MAPTALPL
SCHEMBL1925099 0.75 GSK3B (0.50) RAB9ANPC1SMN1; SMN2MAPTALPL
SCHEMBL1924561 0.75 MAPT (0.49) RAB9ANPC1SMN1; SMN2MAPTALPL
SCHEMBL1924655 0.74 GAA (0.63) RAB9ANPC1SMN1; SMN2MAPTALPL
SCHEMBL7724864 0.74 MAPT (0.68) RAB9ANPC1SMN1; SMN2MAPTALPL
SCHEMBL22728840 0.74 MAPT (0.68) RAB9ANPC1SMN1; SMN2MAPTALPL
SCHEMBL1925116 0.74 GAA (0.67) RAB9ANPC1SMN1; SMN2MAPTALPL
SCHEMBL14886670 0.73 GSK3B (0.52) RAB9ANPC1SMN1; SMN2KDM4EGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7314877-B2 Benzofuran derivative KOWA CO., LTD. (JP) 2008-01-01 — — US disclosed
US-20060189621-A1 Benzofuran derivative KOWA CO., LTD. (JP) 2006-08-24 — — US disclosed
EP-1602655-A1 BENZOFURAN DERIVATIVE Kowa Co., Ltd. (JP) 2005-12-07 — — 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-20060189621-A1 Benzofuran derivative TNF, TNFRSF1A, RELA RAB9A 4218/4885NPC1 337/4885SMN1; SMN2 4472/4885

“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.

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