SCHEMBL11335353

SCHEMBL11335353

CC(=NO)C(=NO)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
TSHR P16473 1/20 0.50
CYP2C19 P33261 1/20 0.50
POLB P06746 2/20 0.35
CASP6 P55212 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
GFER P55789 1/20 0.32
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL11335351 1.00 THRB (0.50) THRBBLMPMP22NPSR1CYP1A2
SCHEMBL1626569 0.79
SCHEMBL1626573 0.79
SCHEMBL3035469 0.79
SCHEMBL548468 0.78
SCHEMBL548467 0.78
SCHEMBL8157700 0.78
SCHEMBL5811359 0.77
SCHEMBL7553617 0.77 NPSR1 (0.47) THRBBLMPMP22NPSR1CYP1A2
Water SCHEMBL548463 0.75

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-4255203-A COMPRISING AN ORGANIC PIGMENT AND AN ARYL BISUREA DERIVATIVE; PRINTING INKS; PAINTS; GLOSS; COLOR INTENSITY, AND FLUID FLOW BASF AKTIENGESELLSCHAFT (DE) 1981-03-10 US disclosed