SCHEMBL3409345

SCHEMBL3409345

C=COCCCCOC(=O)c1c2ccccc2nc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
POLB P06746 3/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 9/20 0.39
ALDH1A1 P00352 6/20 0.39
GLA P06280 3/20 0.39
GAA P10253 2/20 0.39
MAPT P10636 2/20 0.39
NSD2 O96028 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL168796 0.82 TSHR (0.58) TDP1MEN1KMT2APOLBCTDSP1
SCHEMBL216569 0.78 TDP1 (0.73) TDP1KMT2ASMN1; SMN2LMNAALDH1A1
SCHEMBL3753863 0.77 BCHE (0.37) MEN1KMT2ALMNA
SCHEMBL9424810 0.77 MEN1 (0.45) MEN1KMT2APOLBSMN1; SMN2LMNA
SCHEMBL29727362 0.76 TSHR (0.62) TDP1POLBSMN1; SMN2LMNAKDM4E
SCHEMBL14197615 0.76 TSHR (0.62) TDP1POLBSMN1; SMN2LMNAKDM4E
SCHEMBL1151105 0.76 KDM4E (0.47) TDP1MEN1KMT2APOLBLMNA
SCHEMBL27096682 0.76 TSHR (0.49) TDP1POLBSMN1; SMN2LMNAKDM4E
SCHEMBL27984889 0.75 TDP1 (0.39) TDP1LMNAALDH1A1CYP3A4HPGD
SCHEMBL28472675 0.74 TSHR (0.55) TDP1POLBSMN1; SMN2LMNAKDM4E

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
EP-2256170-B1 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications XEROX CORP (US) 2014-12-24 EP disclosed
EP-2256170-A1 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications Xerox Corporation (US) 2010-12-01 EP disclosed