SCHEMBL1532905

SCHEMBL1532905

CCCCC1CCC(C2CCC([O])CC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.52
HTT P42858 2/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
MAPT P10636 1/20 0.42
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
PKM P14618 1/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NAAA Q02083 1/20 0.34
TP53 P04637 1/20 0.33
TLR4 O00206 3/20 0.33
ALDH1A1 P00352 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
SCHEMBL2014332 1.00 CYP1A2 (0.52) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL1008791 0.93 CYP1A2 (0.58) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL10486374 0.89 CYP1A2 (0.64) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL10706384 0.89 CYP1A2 (0.64) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL10486366 0.89 CYP1A2 (0.64) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL1532927 0.86 CYP1A2 (0.50) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL4896964 0.84 CYP1A2 (0.48) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL11831050 0.84 CYP1A2 (0.48) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL6458707 0.84 CYP1A2 (0.58) CYP1A2HTTLMNAMAPK1MAPT
SCHEMBL10704098 0.84 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7898625-B2 Liquid crystal device having a pair of electrodes with a vertical alignment film in which the chiral pitch length to gap ratio (P/G) is 0.06 to less than 1.0 FUJIFILM CORPORATION (JP) 2011-03-01 US disclosed
US-7736533-B2 Liquid crystal composition, liquid crystal device, reflective display material and light modulating material FUJIFILM CORPORATION (JP) 2010-06-15 US disclosed
US-20100039595-A1 LIQUID CRYSTAL DEVICE FUJIFILM CORPORATION (JP) 2010-02-18 US disclosed
US-20090098314-A1 Liquid crystal composition, liquid crystal device, reflective display material and light modulating material FUJIFILM CORPORATION (JP) 2009-04-16 US disclosed