SCHEMBL10694796

SCHEMBL10694796

CCCCOC(=NO)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.47
TDP1 Q9NUW8 4/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
LMNA P02545 6/20 0.44
RAB9A P51151 3/20 0.44
GAA P10253 2/20 0.44
MAPK1 P28482 3/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP3A4 P08684 3/20 0.43
TP53 P04637 2/20 0.42
LTA4H P09960 1/20 0.42
HSD17B10 Q99714 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
ESR1 P03372 1/20 0.41
CYP2D6 P10635 1/20 0.41
NR1H2 P55055 1/20 0.41
RNASEL Q05823 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL6820105 0.93 LMNA (0.50) TSHRTDP1LMNARAB9AGAA
SCHEMBL27512556 0.92 LMNA (0.49) TSHRTDP1LMNARAB9AGAA
SCHEMBL11149732 0.83 TSHR (0.54) TSHRTDP1L3MBTL1LMNAMAPK1
SCHEMBL6920338 0.81 MEN1 (0.44) TSHRL3MBTL1LMNARAB9AGAA
SCHEMBL27849629 0.80 TSHR (0.46) TSHRTDP1L3MBTL1LMNARAB9A
SCHEMBL11204533 0.76 TSHR (0.57) TSHRTDP1L3MBTL1LMNARAB9A
SCHEMBL28978386 0.74 LMNA (0.79) TSHRTDP1L3MBTL1LMNARAB9A
SCHEMBL3287503 0.74 TSHR (0.50) TSHRTDP1L3MBTL1LMNARAB9A
SCHEMBL97514 0.74 LMNA (0.79) TSHRTDP1L3MBTL1LMNARAB9A
SCHEMBL6057166 0.74 LMNA (0.52) TSHRTDP1L3MBTL1LMNAMAPK1

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
EP-0250897-A1 Process for the production of hydroxy-benzaldoxime-0 ethers BAYER AG (DE) 1988-01-07 EP disclosed