SCHEMBL6820105

SCHEMBL6820105

CCCCCCCCCCOC(=NO)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
TSHR P16473 3/20 0.50
ALDH1A1 P00352 3/20 0.50
TP53 P04637 3/20 0.47
CYP3A4 P08684 1/20 0.47
MAPK1 P28482 1/20 0.47
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
HSD17B10 Q99714 2/20 0.45
MAPT P10636 2/20 0.45
GAA P10253 1/20 0.45
ALOX15 P16050 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
PPARG P37231 3/20 0.43
CNR2 P34972 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42

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
SCHEMBL27512556 0.98 LMNA (0.49) LMNATSHRALDH1A1TP53CYP3A4
SCHEMBL10694796 0.93 TSHR (0.47) LMNATSHRALDH1A1TP53CYP3A4
SCHEMBL28996714 0.79 TSHR (0.56) LMNATSHRALDH1A1TP53CYP3A4
SCHEMBL6753648 0.79 TSHR (0.61) LMNATSHRALDH1A1TP53CYP3A4
SCHEMBL6024586 0.78 TSHR (0.53) LMNATSHRALDH1A1TP53CYP3A4
SCHEMBL6024589 0.78 TSHR (0.53) LMNATSHRALDH1A1TP53CYP3A4
SCHEMBL6920338 0.78 MEN1 (0.44) LMNATSHRALDH1A1MAPK1NPC1
SCHEMBL11149732 0.77 TSHR (0.54) LMNATSHRALDH1A1TP53CYP3A4
SCHEMBL11772370 0.77 TSHR (0.41) LMNATSHRALDH1A1CYP3A4
SCHEMBL6057299 0.76 LMNA (0.53) LMNATSHRALDH1A1TP53CYP3A4

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
WO-2004035551-A2 NOVEL FLUORINATED DYE STABILIZERS IN FLUORINATED DIELECTRIC SOLVENT SIPIX IMAGING, INC. (US) 2004-04-29 WO disclosed