SCHEMBL12154686

SCHEMBL12154686

C=COCOCOc1ccc(OCOC)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP9 P14780 1/20 0.35
MMP14 P50281 1/20 0.35
NQO1 P15559 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
ALOX12 P18054 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDR P35968 1/20 0.32
FYN P06241 3/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRNA4 P43681 1/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL7180242 0.83 NQO1 (0.38) NQO1ALDH1A1TP53CYP3A4ALOX15
SCHEMBL3589633 0.80 NQO1 (0.50) MMP2MMP3MMP9MMP14NQO1
SCHEMBL10071494 0.78 CHRNB4 (0.49) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL409780 0.78 CHRNB4 (0.51) MMP2MMP3MMP9MMP14NQO1
SCHEMBL10071499 0.77 CHRNB4 (0.47) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL10071497 0.77 CHRNB4 (0.47) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL10484099 0.74 ALDH1A1 (0.66) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL4216379 0.74 NQO1 (0.40) MMP2MMP3MMP9MMP14NQO1
SCHEMBL8373718 0.73 CHRNA7 (0.47) NQO1ALDH1A1TP53ALOX15TSHR
SCHEMBL197283 0.73 FYN (0.45) MMP2MMP3MMP9MMP14NQO1

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-8049850-B2 Liquid crystal display device, optical compensatory sheet, and polarizer and liquid crystal display device employing the same FUJIFILM CORPORATION (JP) 2011-11-01 US disclosed
US-20090122243-A1 Liquid Crystal Display Device, Optical Compensatory Sheet, and Polarizer and Liquid Crystal Display Device Employing the Same FUJIFILM CORPORATION (JP) 2009-05-14 US disclosed
US-20090033833-A1 Polarizing Plate and Liquid Crystal Display Device Comprising the Same FUJIFILM CORPORATION (JP) 2009-02-05 US disclosed
US-20080218671-A1 TRANSPARENT PROTECTIVE FILM, OPTICAL COMPENSATION FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2008-09-11 US disclosed
US-20080107828-A1 Optically-Compensatory Sheet, Polarizing Plate And Liquid Crystal Display Device FUJIFILM CORPORATION (JP) 2008-05-08 US disclosed