SCHEMBL1819043

SCHEMBL1819043

[c]1cccc(C2CCCC2)c1C1CCCC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.36
HTR7 P34969 1/20 0.36
HTR1D P28221 2/20 0.33
HTR1B P28222 2/20 0.33
TDO2 P48775 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
PTGS2 P35354 1/20 0.33
CEL P19835 2/20 0.32
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 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
SCHEMBL529103 0.98 PTGDR2 (0.36) HTR1AHTR7HTR1DHTR1BTDO2
SCHEMBL9644212 0.98 PTGDR2 (0.36) HTR1AHTR7HTR1DHTR1BTDO2
SCHEMBL16958502 0.91 HTR2C (0.31)
SCHEMBL9586481 0.91 HTR2C (0.31)
SCHEMBL7839191 0.88 HTR2C (0.45) HTR1A
SCHEMBL240648 0.79 CHRNB4 (0.34)
SCHEMBL1814519 0.78 HTR2C (0.32)
SCHEMBL19405543 0.78 MAPT (0.32)
SCHEMBL19405406 0.78 ABCB1 (0.34)
SCHEMBL19405506 0.78 GLA (0.34) CEL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115991724-A Blue phosphorescence bivalent platinum complex, preparation method and application thereof, and organic photoelectric device 中国石油化工股份有限公司 2023-04-21 CN claimed
CN-112125932-A Bivalent platinum complex and application thereof 南京工业大学 2020-12-25 CN disclosed
EP-2513125-A1 METAL COMPLEXES COMPRISING DIAZABENZIMIDAZOL CARBENE-LIGANDS AND THE USE THEREOF IN OLEDS BASF SE (DE) 2012-10-24 EP disclosed
EP-2493906-A1 HETEROLEPTIC CARBENE COMPLEXES AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2012-09-05 EP disclosed
WO-2011073149-A1 METAL COMPLEXES COMPRISING DIAZABENZIMIDAZOL CARBENE-LIGANDS AND THE USE THEREOF IN OLEDS BASF SE (DE) 2011-06-23 WO disclosed
WO-2011051404-A1 HETEROLEPTIC CARBENE COMPLEXES AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2011-05-05 WO disclosed