SCHEMBL12154875

SCHEMBL12154875

C=C(O)C1CCC(C2CCC(CCCCC)CC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
TP53 P04637 1/20 0.44
PKM P14618 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CYP1A2 P05177 3/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
CCR2 P41597 1/20 0.37
MAPT P10636 2/20 0.37
LSS P48449 2/20 0.35
EPHX1 P07099 1/20 0.32
ALOX5 P09917 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
SCHEMBL8010815 0.84 HTT (0.44) HTTLMNAMAPK1TP53PKM
SCHEMBL8221950 0.83 CYP1A2 (0.43) HTTLMNAMAPK1TP53PKM
SCHEMBL10346759 0.82 CYP1A2 (0.54) HTTLMNAMAPK1TP53PKM
SCHEMBL10707112 0.82 CYP1A2 (0.54) HTTLMNAMAPK1TP53PKM
SCHEMBL10346757 0.82 CYP1A2 (0.54) HTTLMNAMAPK1TP53PKM
SCHEMBL1961977 0.82 PKM (0.51) HTTLMNAMAPK1TP53PKM
SCHEMBL1961978 0.82 PKM (0.51) HTTLMNAMAPK1TP53PKM
SCHEMBL4159828 0.82 PKM (0.51) HTTLMNAMAPK1TP53PKM
SCHEMBL4159836 0.82 PKM (0.51) HTTLMNAMAPK1TP53PKM
SCHEMBL21321660 0.81 HTT (0.41) HTTLMNAMAPK1TP53PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3257839-B1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2019-09-04 EP disclosed
EP-1899763-B1 LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORP (JP) 2011-11-16 EP disclosed
WO-2007111387-A1 POLYMER FILM, POLARIZING PLATE PROTECTIVE FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2007-10-04 WO disclosed