SCHEMBL22705679

SCHEMBL22705679

Cn1c2ccccc2c2ccc(-c3cccc4c(-c5cccc6c5C5(c7ccccc7-c7ccccc75)c5ccccc5-6)c5cccc(-c6ccc7c8ccccc8n(C)c7c6)c5cc34)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
GPR3 P46089 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
KIF11 P52732 1/20 0.37
HPGD P15428 4/20 0.35
KDM4E B2RXH2 4/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 3/20 0.35
LMNA P02545 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 3/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
ATM Q13315 1/20 0.34
TSHR P16473 1/20 0.33
PABPC1 P11940 1/20 0.33

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
SCHEMBL22707717 0.93 RXRA (0.39) RXRARXRBGPR3NPC1RAB9A
SCHEMBL22705681 0.93 GPR3 (0.38) RXRARXRBGPR3NPC1RAB9A
SCHEMBL22705707 0.90 RXRA (0.35) RXRARXRBGPR3NPC1RAB9A
SCHEMBL22705691 0.90 RXRA (0.35) RXRARXRBGPR3NPC1RAB9A
SCHEMBL22707145 0.89 RXRA (0.39) RXRARXRBGPR3NPC1RAB9A
SCHEMBL22705891 0.89 RXRA (0.39) RXRARXRBGPR3NPC1RAB9A
SCHEMBL22707185 0.87 RXRA (0.35) RXRARXRBGPR3NPC1RAB9A
SCHEMBL22706443 0.86 RXRA (0.37) RXRARXRBGPR3NPC1RAB9A
SCHEMBL22706547 0.86 KDM4E (0.36) RXRARXRBGPR3L3MBTL1HPGD
SCHEMBL22707713 0.85 RXRA (0.36) RXRARXRBGPR3NPC1RAB9A

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