SCHEMBL11113849

SCHEMBL11113849

C=CCN(OCC)C(=O)CC(C)C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
MAPT P10636 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
SCHEMBL11107395 0.81 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ATSHRMAPT
SCHEMBL11110109 0.77 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ATSHRMAPT
SCHEMBL24011595 0.75 ALDH1A1 (0.54) ALDH1A1MEN1KMT2ATSHRTDP1
SCHEMBL14073868 0.73 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ATSHRTDP1
SCHEMBL11116449 0.72 TSHR (0.47) ALDH1A1MEN1KMT2ATSHRTDP1
SCHEMBL662211 0.70 ALDH1A1 (0.35) ALDH1A1MEN1KMT2ATSHRTDP1
SCHEMBL11113968 0.68 SMN1; SMN2 (0.47) ALDH1A1MEN1KMT2ATSHRMAPT
SCHEMBL28123437 0.68 ALDH1A1 (0.30) ALDH1A1TSHR
SCHEMBL4600793 0.67 ALDH1A1 (0.37) ALDH1A1TDP1
SCHEMBL11113331 0.66 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ATSHRMAPT

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-0103895-A2 Novel hydroxylamine derivatives, production and use thereof MEIJI SEIKA KABUSHIKI KAISHA (JP) 1984-03-28 EP disclosed