SCHEMBL8624256

SCHEMBL8624256

C=C(COCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL8623551 0.83 MAOA (0.38) MAOAMAOBHDAC1HDAC2SMN1; SMN2
SCHEMBL8625967 0.80 MAOA (0.36) MAOAMAOBSMN1; SMN2
SCHEMBL7792771 0.76 MAOA (0.40) MAOAMAOB
SCHEMBL5008736 0.74 MAOA (0.39) MAOAMAOB
SCHEMBL5012369 0.74 MAOA (0.39) MAOAMAOB
SCHEMBL14123664 0.74 MAOA (0.39) MAOAMAOB
SCHEMBL8621299 0.74 ALDH1A1 (0.42) MAOAMAOB
SCHEMBL3752087 0.73 MAOA (0.50) MAOAMAOBSMN1; SMN2
SCHEMBL1996726 0.73 TDP1 (0.54) SMN1; SMN2
SCHEMBL13295231 0.72 MAOA (0.42) MAOAMAOBSMN1; SMN2

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
US-5786434-A A CURABLE COPOLYMER COMPRISING A DIALKYLACRYLAMIDE OR METHACRYLAMIDE, A VINYLLACTAM, A BIS(SILICON-CONTAINING ALKYL)FUMARATE MONOMERS; RADIATION TRANSPARENT, HIGH OXYGEN PERMEABILITY MENICON CO., LTD. (JP) 1998-07-28 US disclosed