SCHEMBL9050890

SCHEMBL9050890

CSC(=C[N+](=O)[O-])NCCN(C)CC1CCOC1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.32
MAPT P10636 5/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 2/20 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
SCHEMBL9050883 1.00 ALDH1A1 (0.32) ALDH1A1MAPTLMNAHTT
SCHEMBL8550316 0.83 ALDH1A1 (0.36) ALDH1A1MAPTLMNAHTT
SCHEMBL8550310 0.83 ALDH1A1 (0.36) ALDH1A1MAPTLMNAHTT
SCHEMBL8544397 0.81 ALDH1A1 (0.38) ALDH1A1MAPTLMNAHTT
SCHEMBL8544399 0.81 ALDH1A1 (0.38) ALDH1A1MAPTLMNAHTT
SCHEMBL8549159 0.75
SCHEMBL8549157 0.75
SCHEMBL8550126 0.71 THRB (0.32)
SCHEMBL8550124 0.71 THRB (0.32)
SCHEMBL8545763 0.71 MLYCD (0.31)

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
JP-8269035-A None JP disclosed
JP-H08269035-A INSECTICIDAL (TETRAHYDRO-3-FURANYL) METHYL DERIVATIVE MITSUI TOATSU CHEM INC 1996-10-15 JP disclosed