SCHEMBL3881606

SCHEMBL3881606

O=C1CCCCC1S.O=S(=O)(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.33
CA1 P00915 3/20 0.32
MMP1 P03956 2/20 0.32
MMP2 P08253 2/20 0.32
MMP9 P14780 2/20 0.32
MMP8 P22894 2/20 0.32
MMP13 P45452 2/20 0.32
CA4 P22748 1/20 0.30

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
SCHEMBL3876401 0.99 CA2 (0.35) CA2CA1MMP1MMP2MMP9
Biphenyl SCHEMBL5368712 0.95
Biphenyl SCHEMBL5574676 0.93 CA2 (0.32) CA2CA1MMP1MMP2MMP9
Trifluoromethanesulfonic Acid SCHEMBL2800832 0.84 CA1 (0.35) CA2CA1CA4
Trifluoromethanesulfonic Acid SCHEMBL2797639 0.79
Biphenyl SCHEMBL516027 0.79 KMT2A (0.34) CA2CA1CA4
SCHEMBL27764014 0.76 CA1 (0.43) CA2CA1CA4
SCHEMBL822956 0.73
SCHEMBL4989703 0.71 KMT2A (0.52) CA2CA1CA4
Cyclohexane SCHEMBL8879285 0.71 KMT2A (0.52) CA2CA1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7521169-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2009-04-21 US disclosed
US-20060234153-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2006-10-19 US disclosed
EP-1557718-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR Corporation (JP) 2005-07-27 EP disclosed