SCHEMBL22706277

SCHEMBL22706277

c1ccc(-c2ccc(-c3c4cccc(-c5cc6ccccc6c6c5sc5ccccc56)c4cc4c(-c5cc6ccccc6c6c5sc5ccccc56)cccc34)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.41
PTPN1 P18031 3/20 0.36
GPR84 Q9NQS5 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
NQO1 P15559 1/20 0.34
NQO2 P16083 1/20 0.34
TNKS O95271 2/20 0.33
TNKS2 Q9H2K2 2/20 0.33
F9 P00740 1/20 0.33
PTPRC P08575 1/20 0.32
PTPRF P10586 1/20 0.32
PTPRA P18433 1/20 0.32
PTPRB P23467 1/20 0.32

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
SCHEMBL22708226 0.97 ALOX5 (0.40) ALOX5PTPN1GPR84L3MBTL1ALDH1A1
SCHEMBL22707315 0.90 ALOX5 (0.39) ALOX5PTPN1GPR84L3MBTL1ALDH1A1
SCHEMBL22707287 0.90 ALOX5 (0.41) ALOX5PTPN1GPR84L3MBTL1ALDH1A1
SCHEMBL22706334 0.89 ALOX5 (0.38) ALOX5NQO1NQO2F9ESR1
SCHEMBL17931894 0.87 PTPN1 (0.40) ALOX5PTPN1GPR84ALDH1A1HPGD
SCHEMBL15784167 0.86 HPGD (0.37) ALOX5PTPN1GPR84L3MBTL1ALDH1A1
SCHEMBL15784279 0.85 ALDH1A1 (0.38) ALOX5PTPN1GPR84L3MBTL1ALDH1A1
SCHEMBL19103061 0.85 PTPN1 (0.37) ALOX5PTPN1GPR84L3MBTL1ALDH1A1
SCHEMBL9951046 0.84 ALOX5 (0.38) ALOX5PTPN1GPR84L3MBTL1ALDH1A1
SCHEMBL15784249 0.83 GPR84 (0.36) ALOX5PTPN1GPR84L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed