SCHEMBL15097124

SCHEMBL15097124

O=C(COc1ccc(F)c2c(=O)c3ccccc3sc12)OCCOCCOCCOC(=O)COc1ccc(F)c2c(=O)c3ccccc3sc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.36
NPC1 O15118 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAB9A P51151 1/20 0.36
MAOA P21397 9/20 0.35
MAOB P27338 9/20 0.35
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
F9 P00740 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL15097132 0.94 HPGD (0.32) HPGDNPC1CYP1A2CYP3A4MAPT
SCHEMBL15097122 0.94 MAOA (0.36) HPGDNPC1CYP1A2CYP3A4MAPT
SCHEMBL15097123 0.91 KMT2A (0.31) HPGDNPC1CYP1A2CYP3A4MAPT
SCHEMBL16785829 0.88 F9 (0.46) HPGDNPC1CYP1A2CYP3A4MAPT
SCHEMBL15097127 0.87 ALDH1A1 (0.34) MAPTMAOAMAOBF9ALDH1A1
SCHEMBL10058703 0.86 MAPT (0.41) HPGDNPC1CYP1A2CYP3A4MAPT
SCHEMBL15097126 0.85 LMNA (0.32) HPGDNPC1CYP1A2CYP3A4MAPT
SCHEMBL2127382 0.84 PTPN1 (0.49) HPGDNPC1CYP1A2CYP3A4MAPT
SCHEMBL25556855 0.80 ALDH1A1 (0.41) HPGDNPC1CYP1A2CYP3A4MAPT
SCHEMBL1614172 0.78 MAPT (0.43) HPGDNPC1CYP1A2CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8985753-B2 LED curable compositions AGFA GRAPHICS NV (BE) 2015-03-24 US disclosed
US-20130176370-A1 LED CURABLE COMPOSITIONS AGFA-GEVAERT N.V. (BE) 2013-07-11 US disclosed