SCHEMBL5146232

SCHEMBL5146232

O=S(=O)(c1ccccc1CCO)c1ccccc1CCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.42
MMP12 P39900 9/20 0.42
MMP13 P45452 8/20 0.42
MMP14 P50281 8/20 0.42
MMP9 P14780 8/20 0.42
MMP8 P22894 6/20 0.42
MMP16 P51512 6/20 0.42
MMP1 P03956 6/20 0.42
MMP3 P08254 6/20 0.42
CYP2D6 P10635 1/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
HSD11B1 P28845 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PTPN1 P18031 1/20 0.36
ADAM17 P78536 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL1807545 0.85 MYC (0.43) MMP2MMP12MMP13MMP14MMP9
SCHEMBL623822 0.83 CA2 (0.47) CA12CA1CA2CA4CA6
SCHEMBL10865912 0.83 MYC (0.42) MMP2MMP12MMP13MMP14MMP9
SCHEMBL29704117 0.83 CA2 (0.47) CA12CA1CA2CA4CA6
SCHEMBL17848762 0.83 MEN1 (0.42) CYP2D6TDP1MEN1KMT2APTPN1
SCHEMBL4434908 0.82 CYP2D6 (0.56) MMP2MMP12MMP13MMP14MMP9
SCHEMBL10865908 0.82 RAD51 (0.40) MMP2MMP12MMP13MMP14MMP9
SCHEMBL2550857 0.79 CYP1A2 (0.45) MMP2MMP12MMP13MMP14MMP9
SCHEMBL587388 0.78 GAA (0.41) MMP2MMP12MMP13MMP14MMP9
SCHEMBL6680949 0.78 TAAR1 (0.50) GAAMEN1KMT2A

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
US-7306894-B2 Polymerizable composition, photopolymerizing method and process for producing lithographic printing plate using the polymerizable composition FUJIFILM CORPORATION (JP) 2007-12-11 US disclosed
EP-1589374-A2 Polymerizable composition, photopolymerizing method and process for producing lithographic printing plate using the polymerizable composition Fuji Photo Film Co., Ltd. (JP) 2005-10-26 EP disclosed
US-20050202341-A1 Polymerizable composition, photopolymerizing method and process for producing lithographic printing plate using the polymerizable composition FUJI PHOTO FILM CO., LTD. 2005-09-15 US disclosed