SCHEMBL10058703

SCHEMBL10058703

O=c1c2ccccc2sc2c(OCCOCCOCCOCCOc3ccc(F)c4c(=O)c5ccccc5sc34)ccc(F)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
RAB9A P51151 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
NPC1 O15118 2/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAOA P21397 5/20 0.38
MAOB P27338 4/20 0.38
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 6/20 0.34
POLB P06746 3/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
LMNA P02545 2/20 0.34
HCRTR1 O43613 1/20 0.34
CHRM2 P08172 2/20 0.34
HTR1A P08908 2/20 0.34
ADRA2A P08913 2/20 0.34
CHRM1 P11229 2/20 0.34

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
SCHEMBL1614172 0.89 MAPT (0.43) MAPTRAB9ACYP1A2CYP3A4NPC1
SCHEMBL13113515 0.88 MAPT (0.42) MAPTRAB9ACYP1A2CYP3A4NPC1
SCHEMBL15097124 0.86 HPGD (0.36) MAPTRAB9ACYP1A2CYP3A4NPC1
SCHEMBL2763154 0.84 NPC1 (0.40) MAPTRAB9ACYP1A2CYP3A4NPC1
SCHEMBL2127382 0.82 PTPN1 (0.49) MAPTRAB9ACYP1A2CYP3A4NPC1
SCHEMBL15097122 0.82 MAOA (0.36) MAPTRAB9ACYP1A2CYP3A4NPC1
SCHEMBL15097132 0.81 HPGD (0.32) MAPTRAB9ACYP1A2CYP3A4NPC1
SCHEMBL25556876 0.81 MAPT (0.58) MAPTRAB9ACYP1A2CYP3A4NPC1
SCHEMBL2125461 0.80 CYP1A2 (0.43) MAPTRAB9ACYP1A2CYP3A4NPC1
SCHEMBL31120499 0.80 ALDH1A1 (0.40) MAPTRAB9ACYP1A2CYP3A4NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2444429-B1 LED CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2016-09-07 EP disclosed
US-8985753-B2 LED curable compositions AGFA GRAPHICS NV (BE) 2015-03-24 US disclosed
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
US-20130176370-A1 LED CURABLE COMPOSITIONS AGFA-GEVAERT N.V. (BE) 2013-07-11 US disclosed
WO-2012052291-A1 LED CURABLE COMPOSITIONS AGFA-GEVAERT (BE) 2012-04-26 WO disclosed