SCHEMBL7748446

SCHEMBL7748446

CCCCCCCCCCCCCCCCCCSCCNC(N)=O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.48
GMNN O75496 1/20 0.48
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
CYP2C9 P11712 1/20 0.48
BLM P54132 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TSHR P16473 1/20 0.45
EPHX1 P07099 7/20 0.44
FAAH O00519 4/20 0.43
CES1 P23141 4/20 0.43
PLA2G6 O60733 1/20 0.43
CA2 P00918 1/20 0.43
CASP2 P42575 1/20 0.40
ZDHHC7 Q9NXF8 1/20 0.39
ALOX15 P16050 1/20 0.38

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
SCHEMBL7749272 1.00 CES2 (0.48) CES2GMNNTP53POLBMAPT
SCHEMBL7749141 0.86 CES2 (0.46) CES2GMNNTP53POLBMAPT
SCHEMBL27486550 0.83 TSHR (0.69) CES2GMNNTP53POLBMAPT
SCHEMBL17633838 0.83 TSHR (0.69) CES2GMNNTP53POLBMAPT
SCHEMBL9164803 0.82 KDM4E (0.41) TSHREPHX1
SCHEMBL9324926 0.81 MEN1 (0.52) CES2GMNNTP53POLBMAPT
SCHEMBL8968727 0.81 MEN1 (0.52) CES2GMNNTP53POLBMAPT
SCHEMBL17137793 0.81 TSHR (0.72) CES2GMNNTP53POLBMAPT
SCHEMBL2185171 0.80 EPHX1 (0.67) EPHX1CASP2
SCHEMBL19468513 0.80 EPHX1 (0.67) EPHX1CASP2

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-6184180-B1 COMPRISES SUPPORT, REVERSIBLE HEAT-SENSITIVE RECORDING LAYER CONTAINING DYE PRECURSOR WHICH IS COLORLESS OR A PALE COLOR, COLOR DEVELOPER CAPABLE OF CAUSING REVERSIBLE CHANGE IN COLOR DENSITY OF DYE DUE TO DIFFERENCE IN COOLING RATE MITSUBISHI PAPER MILLS LIMITED (JP) 2001-02-06 US disclosed
US-5817599-A COLORLESS DYE PRECURSOR AND REVERSIBLE COLOR DEVELOPER MITSUBISHI PAPER MILLS LIMITED (JP) 1998-10-06 US disclosed