SCHEMBL8955689

SCHEMBL8955689

CC(C)COc1ccc(C(C)(C)CC(C)(C)C)cc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.46
MYC P01106 1/20 0.39
MAX P61244 1/20 0.39
AR P10275 1/20 0.39
PELP1 Q8IZL8 1/20 0.39
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL11757783 0.83 ALDH1A1 (0.39) LMNAMAPT
SCHEMBL10352817 0.83 MASP2 (0.50) XDHLMNAMAPT
SCHEMBL8955586 0.77 ALDH1A1 (0.46) XDHLMNAMAPT
SCHEMBL19296839 0.76 ALDH1A1 (0.57) XDHLMNAMAPT
SCHEMBL3032438 0.76 XDH (0.52) XDHLMNAMAPT
SCHEMBL12040911 0.76 MYC (0.50) XDHMYCMAXARPELP1
SCHEMBL1330479 0.75 XDH (0.51) XDHMYCMAXARPELP1
SCHEMBL25323753 0.74 RAB9A (0.54) XDHLMNAMAPT
SCHEMBL6554667 0.74 CYP3A4 (0.51) ARLMNAMAPT
SCHEMBL10385267 0.74 TSHR (0.51) LMNAMAPT

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-0690344-A1 Silver halide color photographic light-sensitive material KONICA CORPORATION (JP) 1996-01-03 EP disclosed