SCHEMBL21985122

SCHEMBL21985122

C1=Cc2ccc3ccc(-c4ccc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)cc4)nc3c2NC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.33
CYP17A1 P05093 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
CLK2 P49760 1/20 0.32
HIPK1 Q86Z02 1/20 0.32
DYRK2 Q92630 1/20 0.32
HIPK2 Q9H2X6 1/20 0.32
HIPK3 Q9H422 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
NOS1 P29475 1/20 0.31
HTR2B P41595 1/20 0.31
HTR5A P47898 1/20 0.31
PARP1 P09874 2/20 0.31
IKBKB O14920 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31

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
SCHEMBL22083371 0.93 CYP17A1 (0.33) CYP17A1CYP19A1CYP11B1CYP11B2PARP1
SCHEMBL16433970 0.90 CYP17A1 (0.33) CYP17A1CYP19A1CYP11B1CYP11B2NOS1
SCHEMBL22083370 0.88 PIM1 (0.32) PIM1PIM2
SCHEMBL19486809 0.83 MEN1 (0.34) PARP1PIM1PIM2
SCHEMBL18902560 0.83 PARP1 (0.30) PARP1PIM1PIM2
SCHEMBL26901615 0.80 CCR1 (0.37) CYP17A1CYP19A1CYP11B1CYP11B2CLK2
SCHEMBL22281676 0.79 NPC1 (0.39) NISCHCYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL24250861 0.79 PARP1 (0.40) PARP1PIM1PIM2
SCHEMBL26274339 0.78 CYP1A2 (0.32) CYP1A1CYP1B1
SCHEMBL18852177 0.77 MEN1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219515-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2023-08-02 EP disclosed
EP-3771717-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2023-05-17 EP disclosed
EP-3816175-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2021-05-05 EP disclosed
EP-3771717-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2021-02-03 EP disclosed
EP-3758084-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2020-12-30 EP disclosed
WO-2020116561-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS 出光興産株式会社 2020-06-11 WO disclosed
EP-3345914-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2020-05-13 EP disclosed