SCHEMBL5095141

SCHEMBL5095141

CS(=O)(=O)OCc1cc(-c2ccc3c(c2)CCO3)nn(CC2CC2)c1=O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.35
PTGS2 P35354 2/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
DYRK1A Q13627 2/20 0.35
MAPT P10636 1/20 0.35
CHRM5 P08912 8/20 0.35
MET P08581 1/20 0.34
NPC1 O15118 2/20 0.34
CYP2D6 P10635 1/20 0.33
PADI4 Q9UM07 1/20 0.33
CRHR1 P34998 1/20 0.33
CHRM1 P11229 5/20 0.33
CLK1 P49759 1/20 0.33
NPBWR1 P48145 1/20 0.32

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
SCHEMBL5098163 0.84 GSK3B (0.40) PTGS1PTGS2SMN1; SMN2MAPTMET
SCHEMBL5098222 0.84 DYRK1A (0.41) PTGS1PTGS2RAB9ASMN1; SMN2DYRK1A
SCHEMBL5094797 0.84 RAB9A (0.39) RAB9ASMN1; SMN2DYRK1AMAPTNPC1
SCHEMBL5101554 0.83 NPC1 (0.38) PTGS1PTGS2RAB9AMAPTCHRM5
SCHEMBL5107984 0.83 RAB9A (0.37) RAB9ASMN1; SMN2DYRK1AMAPTCHRM5
SCHEMBL5108059 0.82 NPBWR1 (0.44) PTGS1PTGS2MAPTCYP2D6NPBWR1
SCHEMBL1925023 0.81 PTGS2 (0.34) PTGS1PTGS2CRHR1
SCHEMBL5102133 0.81 CYP11B2 (0.37) RAB9ASMN1; SMN2DYRK1AMAPTCHRM5
SCHEMBL1925362 0.81 PTGS2 (0.46) PTGS1PTGS2
SCHEMBL5108630 0.81 GSK3B (0.40) PTGS1PTGS2MAPTNPBWR1

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 PTGS1 28/4885PTGS2 114/4885RAB9A 4218/4885

“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.