SCHEMBL117002

SCHEMBL117002

CCC(C)(C)C(=O)OCCOCCOC(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
TDP1 Q9NUW8 4/20 0.51
MAPK1 P28482 2/20 0.46
HIF1A Q16665 1/20 0.46
CYP2D6 P10635 2/20 0.46
SLC6A3 Q01959 2/20 0.46
HTR1A P08908 1/20 0.46
SCN1A P35498 1/20 0.46
SCN5A Q14524 1/20 0.46
SCN2A Q99250 1/20 0.46
SCN3A Q9NY46 1/20 0.46
PKM P14618 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
TSHR P16473 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ADRB2 P07550 1/20 0.43
ADRB1 P08588 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
SCHEMBL801373 0.95 LMNA (0.62) LMNATDP1MAPK1HIF1ACYP2D6
SCHEMBL14827300 0.87 LMNA (0.51) LMNATDP1ESR1ESR2TSHR
SCHEMBL11609606 0.86 LMNA (0.57) LMNATDP1MAPK1HIF1ACYP2D6
SCHEMBL12126258 0.85 MAPT (0.49) LMNATDP1MAPK1CYP2D6CYP1A2
SCHEMBL19360471 0.84 HRH3 (0.50) LMNASMN1; SMN2ADRB2ADRB1ADRB3
SCHEMBL19360457 0.84 HRH3 (0.50) LMNASMN1; SMN2ADRB2ADRB1ADRB3
SCHEMBL14521353 0.84 RIPK1 (0.45) LMNATDP1ESR1ESR2
SCHEMBL11306567 0.82 KDM4E (0.48) LMNATDP1PKMTSHRSMN1; SMN2
SCHEMBL18219828 0.82 KDM4E (0.48) LMNATDP1PKMTSHRSMN1; SMN2
SCHEMBL12900758 0.82 KDM4E (0.48) LMNATDP1PKMTSHRSMN1; SMN2

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-9268114-B2 Dispersed composition, polymerizable composition, light shielding color filter, liquid crystal display device having light shielding color filter, solid-state imaging device, wafer-level lens, and imaging unit having wafer-level lens FUJIFILM CORPORATION (JP) 2016-02-23 US disclosed
US-8733919-B2 Active energy ray-curable ink composition, inkjet recording method, and inkjet printed article FUJIFILM CORPORATION (JP) 2014-05-27 US disclosed
US-20120056930-A1 ACTIVE ENERGY RAY-CURABLE INK COMPOSITION, INKJET RECORDING METHOD, AND INKJET PRINTED ARTICLE FUJIFILM CORPORATION (JP) 2012-03-08 US disclosed
US-20110279759-A1 DISPERSED COMPOSITION, POLYMERIZABLE COMPOSITION, LIGHT SHIELDING COLOR FILTER, LIQUID CRYSTAL DISPLAY DEVICE HAVING LIGHT SHIELDING COLOR FILTER, SOLID-STATE IMAGING DEVICE, WAFER-LEVEL LENS, AND IMAGING UNIT HAVING WAFER LEVEL LENS FUJIFILM CORPORATION (JP) 2011-11-17 US disclosed