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Sulfamic Acid Cyclohexyl Ester

Sulfamic Acid Cyclohexyl Ester

SCHEMBL7366020

COc1ccc(C(C#Cc2ccccc2)CNC(=O)CN)cc1OC1CCCC1.NS(=O)(=O)OC1CCCCC1

nearest known ligand 0.44

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Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 20/20 0.44
▸ PDE4B Q07343 15/20 0.43
▸ PDE4C Q08493 15/20 0.43
▸ PDE4D Q08499 15/20 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
SCHEMBL7361991 0.93 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D
Cyclamic Acid SCHEMBL7366017 0.89 PDE4A (0.42) PDE4APDE4BPDE4CPDE4D
SCHEMBL7359443 0.87 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL7358879 0.85 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL7358728 0.84 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL7357871 0.84 PDE4A (0.51) PDE4APDE4BPDE4CPDE4D
SCHEMBL7358660 0.84 PDE4A (0.47) PDE4APDE4BPDE4CPDE4D
SCHEMBL7363382 0.83 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL7361030 0.83 PDE4A (0.47) PDE4APDE4BPDE4CPDE4D
SCHEMBL7357772 0.80 PDE4A (0.47) PDE4APDE4BPDE4CPDE4D

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
EP-0827495-A4 SUBSTITUTED-PENT-4-YNOIC ACIDS SMITHKLINE BEECHAM CORP (US) 1998-11-04 — — EP claimed
EP-0827495-A1 SUBSTITUTED-PENT-4-YNOIC ACIDS SMITHKLINE BEECHAM CORPORATION (US) 1998-03-11 — — EP claimed
WO-1997003945-A1 SUBSTITUTED-PENT-4-YNOIC ACIDS SMITHKLINE BEECHAM CORPORATION (US) 1997-02-06 — — WO claimed
US-6037367-A Substituted-pent-4-ynoic acids SMITHKLINE BEECHAM CORPORATION (US) 2000-03-14 — — US disclosed