SCHEMBL22233752

SCHEMBL22233752

Fc1c(Cl)ccc2c1oc1ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.51
NMUR2 Q9GZQ4 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
ALOX5 P09917 3/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TTR P02766 1/20 0.38
PGR P06401 1/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
OPRD1 P41143 1/20 0.37
OPRK1 P41145 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PTGS2 P35354 1/20 0.37

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
SCHEMBL30985275 1.00 AHR (0.51) AHRNMUR2SMN1; SMN2ALOX5CYP1A2
SCHEMBL19628976 0.78 AHR (0.40) AHRNMUR2CYP1A2CYP2A6NPC1
SCHEMBL22883938 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL12925908 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL23623460 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL23611394 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL22316643 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6
SCHEMBL17076950 0.78 PTGS2 (0.51) AHRALOX5MAPTKDM4EHPGD
SCHEMBL19836207 0.78 PGR (0.43) AHRALOX5CYP1A2ALDH1A1MAPT
SCHEMBL29833195 0.78 AHR (0.51) AHRSMN1; SMN2ALOX5CYP1A2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4307402-A1 ORGANIC LIGHT EMITTING DEVICE Lg Chem, Ltd. (KR) 2024-01-17 EP disclosed
WO-2020149656-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DIODE USING SAME 주식회사 엘지화학 2020-07-23 WO disclosed
WO-2020149656-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DIODE USING SAME 주식회사 엘지화학 2020-07-23 WO disclosed