SCHEMBL4209727

SCHEMBL4209727

O=C(NS(=O)(=O)CC(F)(F)F)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.42
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CA3 P07451 2/20 0.35
CA5A P35218 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
CA12 O43570 2/20 0.35
CA9 Q16790 2/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
EPHX1 P07099 1/20 0.33
CA1 P00915 1/20 0.33
ATR Q13535 1/20 0.31

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
SCHEMBL5131293 0.81 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL13020409 0.80 EPHX1 (0.42) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL26898374 0.78 ALDH1A1 (0.37) CA2ALDH1A1CA12CA9CA1
SCHEMBL22503155 0.76 TSHR (0.37) ALDH1A1
SCHEMBL25768388 0.76 CA2 (0.48) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL14616640 0.75 EPHX1 (0.42) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL4603325 0.74 TGFBR1 (0.35)
SCHEMBL7182151 0.74 CA2 (0.46) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL8213784 0.74 PGR (0.31)
SCHEMBL16593799 0.74 CA2 (0.46) CA2ALDH1A1POLBSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404344-B2 Pressure sensitive adhesive composition, pressure sensitive adhesive sheet and surface protective film NITTO DENKO CORPORATION (JP) 2013-03-26 US disclosed
US-20090029162-A1 PRESSURE SENSITIVE ADHESIVE COMPOSITION, PRESSURE SENSITIVE ADHESIVE SHEET AND SURFACE PROTECTIVE FILM NITTO DENKO CORPORATION (JP) 2009-01-29 US disclosed