SCHEMBL28052055

SCHEMBL28052055

CCCCC1OC(=O)c2cc(NN)ccc21

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOB P27338 16/20 0.54
MAOA P21397 8/20 0.54
ABCB1 P08183 1/20 0.51

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
SCHEMBL6737479 0.85 ABCB1 (0.60) MAOBMAOAABCB1
SCHEMBL6739287 0.84 MAOB (0.55) MAOBMAOAABCB1
SCHEMBL6741234 0.84 MAOB (0.52) MAOBMAOAABCB1
SCHEMBL7100173 0.84 MAOB (0.52) MAOBMAOAABCB1
SCHEMBL6737859 0.84 ABCB1 (0.56) MAOBMAOAABCB1
SCHEMBL6742472 0.83 ABCB1 (0.58) MAOBMAOAABCB1
SCHEMBL6738033 0.82 MAOB (0.57) MAOBMAOA
SCHEMBL6741758 0.82 MAOB (0.57) MAOBMAOA
SCHEMBL6741552 0.82 MAOB (0.57) MAOBMAOA
SCHEMBL6742959 0.81 ABCB1 (0.61) MAOBMAOAABCB1

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
CN-105418596-A 1-[3-butyl-1(3H)-isobenzofuranone-6-yl]-1H-pyrazol-5(4H)-one derivative as well as preparation method and pharmaceutical application UNIV WUHAN SCIENCE & TECH 2016-03-23 CN claimed
CN-120771144-A Application of 3-butyl-6-hydrazino isobenzofuran-1-one in preparation of medicine for treating ischemic cerebral apoplexy 贵州医科大学 2025-10-14 CN disclosed
CN-120771144-A Application of 3-butyl-6-hydrazino isobenzofuran-1-one in preparation of medicine for treating ischemic cerebral apoplexy 贵州医科大学 2025-10-14 CN disclosed
CN-105418596-A 1-[3-butyl-1(3H)-isobenzofuranone-6-yl]-1H-pyrazol-5(4H)-one derivative as well as preparation method and pharmaceutical application UNIV WUHAN SCIENCE & TECH 2016-03-23 CN disclosed
CN-105418596-A 1-[3-butyl-1(3H)-isobenzofuranone-6-yl]-1H-pyrazol-5(4H)-one derivative as well as preparation method and pharmaceutical application UNIV WUHAN SCIENCE & TECH 2016-03-23 CN disclosed