SCHEMBL9762149

SCHEMBL9762149

C=CCN(CC=C)C(=O)ON

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.35
DPP4 P27487 2/20 0.35
MAPT P10636 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 1/20 0.30

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
SCHEMBL4199211 0.76 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2DPP4MAPTLMNA
SCHEMBL18553102 0.76 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2DPP4MAPTPOLB
SCHEMBL10645801 0.76 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2DPP4MAPTPOLB
SCHEMBL16144123 0.76 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2DPP4MAPTPOLB
SCHEMBL9487264 0.76 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2DPP4MAPTPOLB
SCHEMBL1683063 0.74 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2DPP4MAPTPOLB
SCHEMBL7023419 0.73 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2MAPTPOLBLMNA
SCHEMBL3652188 0.72 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2DPP4MAPTPOLB
SCHEMBL569861 0.72 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2DPP4MAPTPOLB
Methyl Alcohol SCHEMBL11376423 0.71 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2MAPTPOLBLMNA

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
US-5057610-A Oxidation, heat and radiation resistance CIBA-GEIGY CORPORATION (US) 1991-10-15 US disclosed
US-4758614-A Compositions stabilized with substituted amino carbamates CIBA-GEIGY CORPORATION (US) 1988-07-19 US disclosed