SCHEMBL31621565

SCHEMBL31621565

CC(C)(C)OC(=O)N1CCc2cc(S(=O)(=O)Cl)ccc2C1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 3/20 0.67
▸ NR1H2 P55055 1/20 0.59
▸ ABHD6 Q9BV23 2/20 0.46
▸ GPR119 Q8TDV5 7/20 0.46
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ CA7 P43166 2/20 0.45
▸ CA9 Q16790 2/20 0.45
▸ CA14 Q9ULX7 2/20 0.45
▸ STS P08842 2/20 0.45
▸ ESR1 P03372 2/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ HDAC1 Q13547 1/20 0.43
▸ DDB1 Q16531 1/20 0.43
▸ CRBN Q96SW2 1/20 0.43

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
SCHEMBL30409191 1.00 ESR2 (0.67) ESR2NR1H2ABHD6GPR119CA1
SCHEMBL19682381 0.95 NR1H2 (0.66) ESR2NR1H2ABHD6GPR119CA1
SCHEMBL14157494 0.90 ESR2 (0.52) ESR2NR1H2GPR119STSMAPK1
SCHEMBL4789776 0.89 ESR2 (0.69) ESR2NR1H2GPR119
SCHEMBL31020127 0.89 ESR2 (0.69) ESR2NR1H2GPR119
SCHEMBL31621666 0.88 ESR2 (0.67) ESR2NR1H2ABHD6GPR119CA1
SCHEMBL30643119 0.82 ESR2 (0.70) ESR2NR1H2ABHD6ESR1MAPK1
SCHEMBL2568732 0.82 ESR2 (0.70) ESR2NR1H2ABHD6ESR1MAPK1
SCHEMBL19684692 0.82 ESR2 (0.78) ESR2NR1H2ABHD6STSESR1
SCHEMBL31621670 0.82 ESR2 (0.78) ESR2NR1H2ABHD6STSESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115703776-B Plasmin inhibitor, preparation method and application thereof 赛诺哈勃药业(成都)有限公司 2025-06-17 — — CN disclosed
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