SCHEMBL8620150

SCHEMBL8620150

COCCOCCOC(F)(F)C(F)(F)Oc1ccc(-c2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC1 Q13547 10/20 0.38
HDAC2 Q92769 10/20 0.38
HDAC3 O15379 7/20 0.38
HDAC4 P56524 7/20 0.38
HDAC7 Q8WUI4 7/20 0.38
HDAC10 Q969S8 7/20 0.38
HDAC11 Q96DB2 7/20 0.38
HDAC8 Q9BY41 7/20 0.38
HDAC6 Q9UBN7 7/20 0.38
HDAC9 Q9UKV0 7/20 0.38
HDAC5 Q9UQL6 7/20 0.38
AR P10275 1/20 0.36
LSS P48449 1/20 0.35
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL8542103 0.87 ESR2 (0.41) ALDH1A1TP53SMN1; SMN2KDM4EMEN1
Biphenyl SCHEMBL28018683 0.76 CA2 (0.45) ALDH1A1SMN1; SMN2LSSCA2KDM4E
SCHEMBL7558866 0.75 RARB (0.43) SMN1; SMN2HDAC1HDAC2HDAC3LMNA
SCHEMBL15561455 0.75 LSS (0.54) MAPTALDH1A1TP53SMN1; SMN2HDAC1
SCHEMBL9809214 0.75 LSS (0.54) MAPTALDH1A1TP53SMN1; SMN2HDAC1
SCHEMBL7564432 0.72 RARB (0.46) MAPTALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL8440604 0.70 KIF11 (0.46) ALDH1A1HDAC1HDAC2HDAC3HDAC4
Biphenyl SCHEMBL18989473 0.70 CA2 (0.41) ALDH1A1SMN1; SMN2LSSPPARGPPARD
SCHEMBL7561627 0.70 LTA4H (0.45) MAPTALDH1A1SMN1; SMN2HDAC1HDAC2
SCHEMBL14232127 0.69 LSS (0.59) HDAC1HDAC2HDAC3HDAC4HDAC7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0736078-B1 CHIRAL LIQUID CRYSTAL COMPOUNDS HAVING A PERFLUOROETHER TERMINAL PORTION MINNESOTA MINING & MFG (US) 1998-06-24 EP disclosed
EP-0736078-A1 CHIRAL LIQUID CRYSTAL COMPOUNDS HAVING A PERFLUOROETHER TERMINAL PORTION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-10-09 EP disclosed
US-5474705-A Electrooptical displays MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-12-12 US disclosed
WO-1995017481-A1 CHIRAL LIQUID CRYSTAL COMPOUNDS HAVING A PERFLUOROETHER TERMINAL PORTION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-06-29 WO disclosed