SCHEMBL16447302

SCHEMBL16447302

O=C([O-])c1ccccc1F.O=C([O-])c1ccccc1F.c1ccc([Bi+2](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.50
CES1 P23141 3/20 0.50
PTPN1 P18031 1/20 0.47
ERCC5 P28715 1/20 0.47
FEN1 P39748 1/20 0.47
ALDH1A1 P00352 3/20 0.47
ALOX15 P16050 1/20 0.47
GAA P10253 1/20 0.43
HPGD P15428 3/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 4/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 2/20 0.40
ALB P02768 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 1/20 0.39
BCHE P06276 1/20 0.38

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
Lithium Ion SCHEMBL9015781 0.84 CES2 (0.62) CES2CES1PTPN1ERCC5FEN1
Silver SCHEMBL11451384 0.84 CES2 (0.62) CES2CES1PTPN1ERCC5FEN1
SCHEMBL10357058 0.84 CES2 (0.62) CES2CES1PTPN1ERCC5FEN1
SCHEMBL9175790 0.84 CES2 (0.62) CES2CES1PTPN1ERCC5FEN1
SCHEMBL5777163 0.79 CES2 (0.52) CES2CES1PTPN1ERCC5FEN1
SCHEMBL4962405 0.78 CES2 (0.50) CES2CES1PTPN1ERCC5FEN1
Bicarbonate SCHEMBL20420877 0.77 CA2 (0.46) CES2CES1ALDH1A1ALOX15HPGD
Acetic Acid SCHEMBL17892007 0.73 HSD17B10 (0.44) CES2CES1ALDH1A1GAAHPGD
Phthalic Acid SCHEMBL11470623 0.72 ALDH1A1 (0.64) CES2CES1ALDH1A1ALOX15HPGD
SCHEMBL97828 0.71 CES2 (0.68) CES2CES1PTPN1ERCC5FEN1

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
US-10707422-B2 Production of organic phosphorescent layers with addition of heavy main group metal complexes SIEMENS AKTIENGESELLSCHAFT (DE) 2020-07-07 US disclosed
US-10347849-B2 Sequential functionalization of phosphorescent emitter layers SIEMENS AKTIENGESELLSCHAFT (DE) 2019-07-09 US disclosed
US-20180182979-A1 Sequential Functionalization Of Phosphorescent Emitter Layers SIEMENS AKTIENGESELLSCHAFT (DE) 2018-06-28 US disclosed
US-20160181540-A1 Production Of Organic Phosphorescent Layers With Addition Of Heavy Main Group Metal Complexes SIEMENS AKTIENGESELLSCHAFT (DE) 2016-06-23 US disclosed
EP-2999766-A1 PRODUCTION OF ORGANIC PHOSPHORESCENT LAYERS WITH ADDITION OF HEAVY MAIN GROUP METAL COMPLEXES Siemens Aktiengesellschaft (DE) 2016-03-30 EP disclosed
WO-2015018539-A1 PRODUCTION OF ORGANIC PHOSPHORESCENT LAYERS WITH ADDITION OF HEAVY MAIN GROUP METAL COMPLEXES SIEMENS AKTIENGESELLSCHAFT (DE) 2015-02-12 WO disclosed