SCHEMBL9000389

SCHEMBL9000389

Oc1ncccc1C=Cc1nc(C=Cc2cccnc2O)c(C=Cc2cccnc2O)nc1C=Cc1cccnc1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.37
▸ FGF23 Q9GZV9 1/20 0.37
▸ MMP2 P08253 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ CHRM1 P11229 1/20 0.35
▸ COMT P21964 1/20 0.35
▸ ADRA1A P35348 1/20 0.35
▸ METAP2 P50579 1/20 0.35
▸ METAP1 P53582 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ NPC1 O15118 5/20 0.35
▸ MAPT P10636 4/20 0.35
▸ RAB9A P51151 4/20 0.35
▸ GAA P10253 2/20 0.35
▸ APP P05067 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ TRIM24 O15164 1/20 0.34
▸ TRIM33 Q9UPN9 1/20 0.34
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 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
SCHEMBL20070416 0.78 KDM4E (0.36) KDM4EFGF23MMP2TSHRCHRM1
SCHEMBL9000312 0.76 NFE2L2 (0.49) KDM4ENPC1MAPTRAB9AMAPK1
SCHEMBL9000369 0.76 FGF23 (0.41) KDM4EFGF23MMP2TSHRNPC1
SCHEMBL9000547 0.75 MMP2 (0.47) KDM4EFGF23MMP2TSHRCHRM1
SCHEMBL9000718 0.74 KDM4E (0.50) KDM4EMMP2TSHRCHRM1COMT
SCHEMBL9000723 0.74 KDM4E (0.50) KDM4EMMP2TSHRCHRM1COMT
SCHEMBL9000474 0.74 KDM4E (0.50) KDM4ETSHRNPC1MAPTRAB9A
SCHEMBL3439424 0.72 — —
SCHEMBL7216828 0.72 — —
SCHEMBL5809339 0.72 — —

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
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