SCHEMBL7002245

SCHEMBL7002245

CC(C)OC(=O)CCCCCCC/C=C/CCCCCCCCS

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
PGR P06401 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
ADRA2C P18825 1/20 0.47
SLC6A2 P23975 1/20 0.47
HTR2B P41595 1/20 0.47
MC3R P41968 1/20 0.47
SLC6A3 Q01959 1/20 0.47
PDE4D Q08499 1/20 0.47
SCN5A Q14524 1/20 0.47
PRKCA P17252 2/20 0.47
PRKCE Q02156 1/20 0.47
PRKCQ Q04759 1/20 0.47
PRKCD Q05655 1/20 0.47
DAGLA Q9Y4D2 2/20 0.44
ALDH1A1 P00352 2/20 0.43
FAAH O00519 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
CNR1 P21554 1/20 0.43

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
SCHEMBL19571072 0.91 LMNA (0.66) LMNAPGRADORA3ADRA2CSLC6A2
SCHEMBL10075911 0.91 LMNA (0.66) LMNAPGRADORA3ADRA2CSLC6A2
SCHEMBL6741044 0.88 LMNA (0.64) LMNAPGRADORA3ADRA2CSLC6A2
SCHEMBL7003214 0.86 PRKCA (0.47) LMNAPRKCAPRKCEPRKCQPRKCD
SCHEMBL23754250 0.85 LMNA (0.62) LMNAPGRADORA3ADRA2CSLC6A2
SCHEMBL12615033 0.85 LMNA (0.62) LMNAPGRADORA3ADRA2CSLC6A2
SCHEMBL3656513 0.85 LMNA (0.79) LMNAPGRADORA3SLC6A2PRKCA
SCHEMBL6429415 0.85 LMNA (0.79) LMNAPGRADORA3SLC6A2PRKCA
SCHEMBL10338455 0.85 LMNA (0.79) LMNAPGRADORA3SLC6A2PRKCA
SCHEMBL61998 0.85 LMNA (0.79) LMNAPGRADORA3SLC6A2PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012062655-A2 PHOTOPOLYMER FORMULATION FOR PRODUCING HOLOGRAPHIC MEDIA HAVING HIGHLY CROSS-LINKED MATRIX POLYMERS BAYER MATERIALSCIENCE AG (DE) 2012-05-18 WO disclosed