SCHEMBL7783064

SCHEMBL7783064

O=C1CCC(C2(C3CCCCC3)CCCCC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
TRIM24 O15164 2/20 0.36
TRIM33 Q9UPN9 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP19A1 P11511 2/20 0.33
TBXAS1 P24557 1/20 0.32
SCN1A P35498 1/20 0.31
SCN4A P35499 1/20 0.31
SCN7A Q01118 1/20 0.31
KCNH2 Q12809 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31
SCN2A Q99250 1/20 0.31
SCN3A Q9NY46 1/20 0.31
SCN11A Q9UI33 1/20 0.31
SCN8A Q9UQD0 1/20 0.31
SCN10A Q9Y5Y9 1/20 0.31
KMT2A Q03164 1/20 0.31
HTT P42858 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
SCHEMBL15763622 0.86 TRIM24 (0.39) LMNATSHRTRIM24TRIM33ALDH1A1
SCHEMBL7783061 0.81 MEN1 (0.33) LMNATSHRTRIM24TRIM33ALDH1A1
SCHEMBL4697737 0.81 SCN1A (0.41) LMNATSHRSCN1ASCN4ASCN7A
SCHEMBL30492082 0.81 SCN1A (0.41) LMNATSHRSCN1ASCN4ASCN7A
SCHEMBL1630078 0.81 SCN1A (0.41) LMNATSHRSCN1ASCN4ASCN7A
SCHEMBL181178 0.81 SCN1A (0.41) LMNATSHRSCN1ASCN4ASCN7A
SCHEMBL8529811 0.81 SCN1A (0.41) LMNATSHRSCN1ASCN4ASCN7A
SCHEMBL2993610 0.81 SCN1A (0.41) LMNATSHRSCN1ASCN4ASCN7A
SCHEMBL4655278 0.81 SCN1A (0.41) LMNATSHRSCN1ASCN4ASCN7A
SCHEMBL6079568 0.78 SCN1A (0.39) LMNATSHRSCN1ASCN4ASCN7A

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-0637623-B1 Cyclic hydrocarbon derivative and liquid crystal composition containing the same DAINIPPON INK & CHEMICALS (JP) 2001-10-04 EP disclosed
US-5536443-A DUTERIUM CONTAINING COMPOUNDS FOOR ELECTROOPTICAL APPARATUS DAINIPPON INK & CHEMICALS, INC. (JP) 1996-07-16 US disclosed
US-5474707-A Electrooptic display DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-12-12 US disclosed
EP-0637623-A1 Cyclic hydrocarbon derivative and liquid crystal composition containing the same DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-02-08 EP disclosed