SCHEMBL3957183

SCHEMBL3957183

CCCCOC1C=C[CH]c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EYA2 O00167 1/20 0.47
RET P07949 2/20 0.40
TSHR P16473 5/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
LTA4H P09960 2/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TP53 P04637 4/20 0.33
GAA P10253 2/20 0.33
HTR1D P28221 2/20 0.33
HTR1B P28222 2/20 0.33
HTT P42858 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPK1 P28482 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL29815940 0.84 EYA2 (0.43) EYA2RETTSHRTDP1L3MBTL1
SCHEMBL40508 0.83 RET (0.40) EYA2RETLMNA
SCHEMBL5031539 0.79 EYA2 (0.48) EYA2RETTSHRTDP1L3MBTL1
SCHEMBL5031504 0.78 EYA2 (0.50) EYA2RETTSHRLTA4HTP53
SCHEMBL31740759 0.78 EYA2 (0.50) EYA2RETTSHRLTA4HTP53
SCHEMBL4630745 0.76 RET (0.37) RET
SCHEMBL290935 0.74 RET (0.36) RET
SCHEMBL29434193 0.73 RET (0.44) EYA2RETTP53HTR1DHTR1B
SCHEMBL4310326 0.73 EYA2 (0.40) EYA2TSHRTDP1L3MBTL1LTA4H
SCHEMBL8030752 0.72 BCHE (0.34) EYA2TP53KDM4EHSD17B10CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2031670-A1 ORGANIC ELECTROLUMINESCENT DEVICE EMPLOYING HETEROCYCLE-CONTAINING ARYLAMINE DERIVATIVE Idemitsu Kosan Co., Ltd. (JP) 2009-03-04 EP disclosed