SCHEMBL21296093

SCHEMBL21296093

[c]1csc2ccc(-c3ccccn3)cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.48
PIK3CA P42336 1/20 0.48
PI4KA P42356 1/20 0.48
PIK3CG P48736 1/20 0.48
PI4KB Q9UBF8 1/20 0.48
KDM4E B2RXH2 9/20 0.40
RAB9A P51151 5/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPK1 P28482 2/20 0.40
LMNA P02545 3/20 0.39
CCR1 P32246 3/20 0.39
CCR5 P51681 3/20 0.39
CCR8 P51685 3/20 0.39
CYP1A2 P05177 2/20 0.39
POLB P06746 1/20 0.39
METAP1 P53582 1/20 0.39
BLM P54132 1/20 0.39
HIF1A Q16665 1/20 0.39
DOHH Q9BU89 1/20 0.39
P4HTM Q9NXG6 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
SCHEMBL21295875 0.88 PIK3CD (0.48) PIK3CDPIK3CAPI4KAPIK3CGPI4KB
SCHEMBL21295652 0.76 F9 (0.39) PIK3CAPI4KAPI4KBKDM4ERAB9A
SCHEMBL21295618 0.73 PIK3CD (0.46) PIK3CDPIK3CAPI4KAPIK3CGPI4KB
SCHEMBL28914712 0.72 PIK3CD (0.48) PIK3CDPIK3CAPI4KAPI4KBALDH1A1
SCHEMBL28914083 0.69 PIK3CD (0.48) PIK3CDPIK3CAPI4KAPIK3CGPI4KB
SCHEMBL21295762 0.69 PIK3CD (0.41) PIK3CDPIK3CAPI4KAPIK3CGPI4KB
SCHEMBL1566968 0.69 KDM4E (0.72) KDM4ERAB9AALDH1A1MAPK1LMNA
SCHEMBL30989132 0.69 KDM4E (0.72) KDM4ERAB9AALDH1A1MAPK1LMNA
SCHEMBL30989133 0.69 KDM4E (0.72) KDM4ERAB9AALDH1A1MAPK1LMNA
SCHEMBL26260190 0.68 KDM4E (0.57) PIK3CDPIK3CAPI4KAPIK3CGPI4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 CN disclosed
CN-112912372-A Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2021-06-04 CN disclosed
WO-2020085319-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2020-04-30 WO disclosed
WO-2019163959-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCNET ELEMENT, AND ELECTRON-TRANSPORTING MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2019-08-29 WO disclosed