SCHEMBL18900446

SCHEMBL18900446

Cc1ccc(S(=O)(=O)OC(CC(C)C)C(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 6/20 0.43
▸ CA1 P00915 5/20 0.43
▸ CA9 Q16790 4/20 0.43
▸ CA4 P22748 1/20 0.43
▸ CA7 P43166 3/20 0.41
▸ DHODH Q02127 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ GBA1 P04062 1/20 0.38
▸ ALDH1A1 P00352 5/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CA12 O43570 2/20 0.37
▸ VDR P11473 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CA3 P07451 1/20 0.37
▸ CA6 P23280 1/20 0.37
▸ CA5A P35218 1/20 0.37

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
SCHEMBL20987329 0.87 CYP24A1 (0.38) CA2CA1CA9CA4CA7
SCHEMBL14778660 0.86 CA2 (0.42) CA2CA1CA9CA7DHODH
SCHEMBL18718195 0.84 CA2 (0.46) CA2CA1CA9CA4CA7
SCHEMBL14778447 0.84 CA2 (0.46) CA2CA1CA9CA4CA7
Phosphine SCHEMBL3415127 0.83 CA2 (0.45) CA2CA1CA9CA4CA7
SCHEMBL5275738 0.82 CA2 (0.50) CA2CA1CA9CA7DHODH
SCHEMBL11185625 0.82 DHODH (0.39) CA2CA1CA9CA7DHODH
SCHEMBL11188915 0.82 DHODH (0.39) CA2CA1CA9CA7DHODH
SCHEMBL18900536 0.81 ALDH1A1 (0.42) CA2CA1CA9CA4CA7
SCHEMBL18903909 0.81 CYP24A1 (0.48) CA2CA1CA9CA4CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3297838-B1 LASER MARKABLE MATERIALS AND DOCUMENTS AGFA GEVAERT (BE) 2019-08-28 — — EP disclosed
EP-3297841-B1 LASER MARKABLE COMPOSITIONS, ARTICLES AND DOCUMENTS AGFA GEVAERT (BE) 2019-08-07 — — EP disclosed
EP-3297837-B1 LASER MARKABLE COMPOSITIONS, ARTICLES AND DOCUMENTS AGFA GEVAERT (BE) 2019-07-31 — — EP disclosed
US-20180134055-A1 LASER MARKABLE COMPOSITIONS, ARTICLES AND DOCUMENTS AGFA-GEVAERT (BE) 2018-05-17 — — US disclosed
EP-3252680-A1 AUTHENTICATION METHOD OF A TWO DIMENSIONAL BAR CODE Agfa Graphics NV (BE) 2017-12-06 — — EP disclosed
EP-3173246-A1 INKJET INK SET FOR A METHOD OF MANUFACTURING A PACKAGING Agfa Graphics NV (BE) 2017-05-31 — — EP disclosed
EP-3173249-A1 LASER MARKABLE COMPOSITIONS AND METHODS TO MANUFACTURE A PACKAGING THEREWITH AGFA-GEVAERT (BE) 2017-05-31 — — EP disclosed
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