SCHEMBL5854747

SCHEMBL5854747

COc1cc(Nc2ccccc2)ccc1[N+]#N.O=S(=O)([O-])OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 3/20 0.40
CTSL P07711 3/20 0.40
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
STK10 O94804 1/20 0.37
SLK Q9H2G2 1/20 0.37
TNF P01375 1/20 0.36
NOD2 Q9HC29 1/20 0.36
NOD1 Q9Y239 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 1/20 0.35
EGFR P00533 1/20 0.35
CA12 O43570 1/20 0.35

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
Sulfuric Acid SCHEMBL1123017 0.87 PPARG (0.44) PPARGPPARDPPARAKMT2AMEN1
Sulfuric Acid SCHEMBL6929881 0.86 PPARG (0.43) PPARGPPARDPPARAKMT2AMEN1
Sulfuric Acid SCHEMBL5698877 0.85 MEN1 (0.45) PPARGPPARDPPARAKMT2AMEN1
SCHEMBL5856325 0.85 CTSV (0.37) CTSVCTSLPPARGPPARDPPARA
Amylosulfuric Acid SCHEMBL5854420 0.84 PPARG (0.41) PPARGPPARDPPARAKMT2AMEN1
SCHEMBL1764456 0.84 PPARG (0.43) PPARGPPARDPPARAKMT2AMEN1
Octadecyl Sulfate SCHEMBL5856693 0.83 RECQL (0.41) PPARGPPARDPPARAKMT2AMEN1
SCHEMBL5669228 0.83 RECQL (0.41) PPARGPPARDPPARAKMT2AMEN1
SCHEMBL1716138 0.83 RECQL (0.41) PPARGPPARDPPARAKMT2AMEN1
SCHEMBL5854177 0.83 RECQL (0.41) PPARGPPARDPPARAKMT2AMEN1

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-7045269-B2 Method for forming images using negative working imageable elements EASTMAN KODAK COMPANY (US) 2006-05-16 US disclosed
WO-2005051663-A1 METHOD FOR FORMING IMAGES USING NEGATIVE WORKING IMAGEABLE ELEMENTS KODAK POLYCHROME GRAPHICS LLC (US) 2005-06-09 WO disclosed
US-20040180291-A1 Method for forming images using negative working imageable elements CITICORP NORTH AMERICA, INC., AS AGENT 2004-09-16 US disclosed