SCHEMBL19301158

SCHEMBL19301158

O=[N+]([O-])c1ccccc1-c1ccc2c3c1ccc1c4c(cc(c13)n2-c1ccccc1)[nH]c1ccccc14

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.40
▸ WEE1 P30291 1/20 0.40
▸ KMT2A Q03164 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MPI P34949 1/20 0.39
▸ APOBEC3G Q9HC16 1/20 0.39
▸ GUSB P08236 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ MGAM O43451 2/20 0.33
▸ PLA2G10 O15496 1/20 0.33
▸ PLA2G2A P14555 1/20 0.33
▸ PLA2G5 P39877 1/20 0.33
▸ PLA2G12A Q9BZM1 1/20 0.33
▸ CTSV O60911 1/20 0.33
▸ CTSL P07711 1/20 0.33
▸ F2 P00734 1/20 0.33
▸ C1R P00736 1/20 0.33
▸ GABRP O00591 2/20 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
SCHEMBL19301156 0.84 MEN1 (0.38) KMT2AMEN1ALDH1A1MPIAPOBEC3G
SCHEMBL19301160 0.78 ALDH1A1 (0.40) KMT2AMEN1ALDH1A1MPIAPOBEC3G
SCHEMBL15834581 0.77 ALDH1A1 (0.39) KMT2AMEN1ALDH1A1MPIAPOBEC3G
SCHEMBL19301157 0.76 PDE7A (0.38) KMT2AMEN1ALDH1A1MGAMGABRP
SCHEMBL19301159 0.74 KDM4E (0.46) KMT2AMEN1ALDH1A1MAPTGABRP
SCHEMBL25800756 0.73 KMT2A (0.55) CHEK1WEE1KMT2AMEN1ALDH1A1
SCHEMBL19301176 0.72 LMNA (0.32) KMT2AMEN1ALDH1A1
SCHEMBL17841973 0.72 HPRT1 (0.49) CHEK1WEE1KMT2AMEN1ALDH1A1
SCHEMBL20595209 0.71 KDM4E (0.46) KMT2AMEN1ALDH1A1GUSBTDP1
SCHEMBL30562779 0.71 KDM4E (0.46) KMT2AMEN1ALDH1A1GUSBTDP1

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
WO-2017146406-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2017-08-31 — — WO disclosed
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