SCHEMBL28274288

SCHEMBL28274288

[c]1ccc(-c2ccc3cnccc3c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 1/20 0.56
CYP11B1 P15538 7/20 0.44
CYP11B2 P19099 7/20 0.44
CYP19A1 P11511 4/20 0.44
CYP17A1 P05093 4/20 0.44
TDO2 P48775 1/20 0.44
ALOX15 P16050 2/20 0.43
FASN P49327 1/20 0.42
AKT1 P31749 4/20 0.40
CDK2 P24941 2/20 0.39
DYRK3 O43781 1/20 0.39
ROCK2 O75116 1/20 0.39
PRKD3 O94806 1/20 0.39
MAP4K4 O95819 1/20 0.39
CDK1 P06493 1/20 0.39
ROS1 P08922 1/20 0.39
PIM1 P11309 1/20 0.39
PRKACA P17612 1/20 0.39
RPS6KB1 P23443 1/20 0.39
CLK2 P49760 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
SCHEMBL21295671 0.93 PRKCZ (0.66) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL444504 0.84 PRKCZ (0.63) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL6355545 0.81 CYP11B2 (0.61) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL21295767 0.80 CYP11B2 (0.47) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL23555375 0.79 PRKCZ (0.58) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL7284233 0.79 ESR2 (0.61) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL28933997 0.79 CYP11B1 (0.59) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL29449786 0.79 CYP11B1 (0.59) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL8338721 0.79 PRKCZ (0.58) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL18891280 0.79 CYP11B1 (0.69) PRKCZCYP11B1CYP11B2CYP19A1CYP17A1

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
CN-109311844-A Triaizine compounds, its manufacturing method and the organic electroluminescent device as constituent 东曹株式会社 2019-02-05 CN disclosed
CN-106573912-A Triazine compound, method for producing same, and application for same 东曹株式会社 2017-04-19 CN disclosed