SCHEMBL16301147

SCHEMBL16301147

O=C(NC(C1CCCCC1)(C1CCCCC1)C1CCCCC1)S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.33
EPHX1 P07099 6/20 0.31
NPC1 O15118 4/20 0.31
SMN1; SMN2 Q16637 4/20 0.31
RAB9A P51151 3/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA7 P43166 1/20 0.31
CA14 Q9ULX7 1/20 0.31
MAPT P10636 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
EPHX2 P34913 1/20 0.31
MAPK1 P28482 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN5 P54829 1/20 0.31
PTPN11 Q06124 1/20 0.31
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 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
SCHEMBL10272627 0.74 ALDH1A1 (0.36) SSTR4ALDH1A1
SCHEMBL3977832 0.68 NOS2 (0.37) SMN1; SMN2ALDH1A1CYP3A4
SCHEMBL879448 0.66 PTGS1 (0.34)
SCHEMBL3978855 0.66 NOS2 (0.39) SMN1; SMN2ALDH1A1CYP3A4
SCHEMBL8328164 0.61 KEAP1 (0.42) SSTR4EPHX1NPC1SMN1; SMN2RAB9A
SCHEMBL1049323 0.61 SSTR4 (0.37) SSTR4EPHX1CA12CA1CA7
SCHEMBL3874080 0.61 ALDH1A1 (0.32) CA12CA1CA7CA14ALDH1A1
SCHEMBL21136020 0.61 CA1 (0.33) CA12CA1CA7CA14ALDH1A1
SCHEMBL21269265 0.60 KEAP1 (0.41) SSTR4EPHX1NPC1SMN1; SMN2RAB9A
SCHEMBL7080108 0.60 EPHX1 (0.41) SSTR4EPHX1NPC1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120076996-A1 RESIST COMPOSITION, RESIST FILM THEREFROM AND METHOD OF FORMING PATTERN THEREWITH FUJIFILM CORPORATION (JP) 2012-03-29 US disclosed