SCHEMBL8625966

SCHEMBL8625966

C=Cc1ccccc1COCC(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
XBP1 P17861 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL8621297 0.84 IDO1 (0.36) ALDH1A1
SCHEMBL8624261 0.81
SCHEMBL7791503 0.79 ALDH1A1 (0.35) ALDH1A1
SCHEMBL252296 0.78 ALDH1A1 (0.43) LMNAHPGDSMN1; SMN2ALDH1A1
SCHEMBL8623549 0.75 ALDH1A1 (0.32) ALDH1A1
SCHEMBL7792768 0.74 ALDH1A1 (0.34) ALDH1A1
SCHEMBL7790933 0.72 ALDH1A1 (0.37) ALDH1A1
SCHEMBL1906074 0.72 ALDH1A1 (0.38) HPGDL3MBTL1ALDH1A1
Hydroquinone SCHEMBL4865328 0.72 ALDH1A1 (0.38) LMNAL3MBTL1ALDH1A1
SCHEMBL194629 0.72 ALDH1A1 (0.38) NPSR1L3MBTL1ALDH1A1

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-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
US-5556929-A FROM UNSATURATED DIESTER WITH URETHANE AND FLUORINE GROUPS AND ACRYLATED SILOXANE, CONTACT LENSES MENICON CO., LTD. (JP) 1996-09-17 US disclosed