SCHEMBL9385131

SCHEMBL9385131

Cc1ccc(S(=O)(=O)N=S(=O)(C(C)C)C(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.48
▸ PRSS1 P07477 2/20 0.48
▸ PRSS2 P07478 2/20 0.48
▸ PRSS3 P35030 2/20 0.48
▸ GAA P10253 3/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ CA1 P00915 2/20 0.43
▸ CA2 P00918 2/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA3 P07451 1/20 0.43
▸ CA6 P23280 1/20 0.43
▸ CA5A P35218 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA9 Q16790 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
SCHEMBL135563 0.77 F2 (0.53) F2PRSS1PRSS2PRSS3GAA
SCHEMBL9738285 0.77 F2 (0.53) F2PRSS1PRSS2PRSS3GAA
SCHEMBL127246 0.76 F2 (0.57) F2PRSS1PRSS2PRSS3GAA
SCHEMBL27438698 0.76 BCHE (0.40) F2PRSS1PRSS2PRSS3GAA
SCHEMBL18085631 0.75 ALDH1A1 (0.42) F2PRSS1PRSS2PRSS3GAA
SCHEMBL16042071 0.73 F2 (0.50) F2PRSS1PRSS2PRSS3GAA
SCHEMBL12377380 0.73 GAA (0.52) F2PRSS1PRSS2PRSS3GAA
SCHEMBL5138891 0.73 F2 (0.59) F2PRSS1PRSS2PRSS3GAA
SCHEMBL663730 0.72 CYP2C19 (0.59) F2PRSS1PRSS2PRSS3GAA
SCHEMBL9057442 0.72 F2 (0.63) F2PRSS1PRSS2PRSS3GAA

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-0436199-B1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LAB (US) 1994-08-03 — — EP disclosed
US-5120752-A N-(1-(20(3-pyridyloxy)phenyl)cyclopropyl) alkyl-N-hydroxyurea compounds, antiinflammatory agents ABBOTT LABORATORIES (US) 1992-06-09 — — US disclosed
US-5037853-A Antiinflammatory agents ABBOTT LABORATORIES (US) 1991-08-06 — — US disclosed
EP-0436199-A1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LABORATORIES (US) 1991-07-10 — — EP disclosed
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