SCHEMBL9000375

SCHEMBL9000375

C(=C/c1cccc2ncccc12)\c1nc(/C=C/c2cccc3ncccc23)c(/C=C/c2cccc3ncccc23)nc1/C=C/c1cccc2ncccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.54
MAPT P10636 4/20 0.54
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
HPGD P15428 3/20 0.54
CYP1A2 P05177 2/20 0.54
HSD17B10 Q99714 2/20 0.54
CYP2C9 P11712 1/20 0.54
ALOX15 P16050 1/20 0.54
CYP2C19 P33261 1/20 0.54
MAPK1 P28482 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP11B2 P19099 2/20 0.42
HSP90AA1 P07900 1/20 0.42

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
SCHEMBL9000381 1.00 KDM4E (0.54) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL9000553 0.87 MAPT (0.65) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL9665295 0.87 MAPT (0.65) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL6850607 0.80 MAPT (0.54) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL11652810 0.80 MAPT (0.54) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL31686425 0.79 MAPT (0.56) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL6851852 0.76 MAPT (0.48) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL6851864 0.76 MAPT (0.48) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL1239664 0.76 MAPT (0.58) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL14127415 0.76 MAPT (0.58) KDM4EMAPTALDH1A1MEN1KMT2A

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
EP-0516409-B1 Tetravinylpyrazine compound, method for preparing same and electroluminescent element and non-linear optical material using same MITSUI TOATSU CHEMICALS (JP) 1996-09-11 EP disclosed
US-5416213-A Tetravinylpyrazine compound, method for preparing same and electroluminescent element and non-linear optical material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1995-05-16 US disclosed
EP-0516409-A2 Tetravinylpyrazine compound, method for preparing same and electroluminescent element and non-linear optical material using same MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-12-02 EP disclosed