SCHEMBL9407012

SCHEMBL9407012

CCCCC1CCC(CCBr)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.58
HTT P42858 2/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
MAPT P10636 1/20 0.42
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
NAAA Q02083 1/20 0.36
PKM P14618 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TP53 P04637 1/20 0.33
EPHX1 P07099 1/20 0.32
CCR2 P41597 1/20 0.32
LSS P48449 1/20 0.32

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
SCHEMBL9407009 1.00 CYP1A2 (0.58) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL19478341 0.93 CYP1A2 (0.64) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL8014247 0.93 CYP1A2 (0.50) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL6748514 0.93 CYP1A2 (0.50) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL10005570 0.91 CYP1A2 (0.75) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL9552363 0.87 CYP1A2 (0.45) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL5691762 0.87 CYP1A2 (0.74) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL97616 0.87
SCHEMBL7913395 0.85 CYP1A2 (0.58) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL7751705 0.85 CYP1A2 (0.58) CYP1A2HTTLMNAMAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5354502-A Very large dielectric anisotropy and small birefringence SEIKO EPSON CORPORATION (JP) 1994-10-11 US disclosed
US-5238599-A Low threshold voltage, low driving voltage SEIKO EPSON CORPORATION (JP) 1993-08-24 US disclosed
EP-0447565-A1 1,3-DIOXANE DERIVATIVE AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE SAME SEIKO EPSON CORPORATION (JP) 1991-09-25 EP disclosed
EP-0400861-A1 1,3-dioxane derivative and liquid crystal composition incorporating the same SEIKO EPSON CORPORATION (JP) 1990-12-05 EP disclosed
US-4723018-A USED IN FERROELECTRIC LIQUID CRYSTAL DISPLAYS SEIKO EPSON CORPORATION (JP) 1988-02-02 US disclosed