SCHEMBL22906536

SCHEMBL22906536

Cn1c2ccccc2c2ccc(-c3ccc4c5ccccc5n(-c5cccc(-c6ccccc6)c5)c4c3)cc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.54
▸ RXRB P28702 1/20 0.54
▸ KDM4E B2RXH2 4/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ ATM Q13315 2/20 0.47
▸ GPR3 P46089 1/20 0.46
▸ MAOB P27338 1/20 0.44
▸ KIF11 P52732 1/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ HPGD P15428 3/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ RXFP1 Q9HBX9 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ LIMK1 P53667 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL26528281 0.94 RXRA (0.48) RXRARXRBKDM4EL3MBTL1ATM
SCHEMBL26528317 0.93 RXRA (0.47) RXRARXRBKDM4EL3MBTL1ATM
SCHEMBL18415794 0.93 KDM4E (0.49) RXRARXRBKDM4EL3MBTL1ATM
SCHEMBL17038399 0.93 RXRA (0.56) RXRARXRBKDM4EL3MBTL1ATM
SCHEMBL23225793 0.91 KDM4E (0.47) RXRARXRBKDM4EL3MBTL1ATM
SCHEMBL23225667 0.91 KDM4E (0.47) RXRARXRBKDM4EL3MBTL1ATM
SCHEMBL17038394 0.91 RXRA (0.53) RXRARXRBKDM4EL3MBTL1ATM
SCHEMBL18416268 0.91 KDM4E (0.58) RXRARXRBKDM4EL3MBTL1ATM
SCHEMBL18563946 0.91 KDM4E (0.58) RXRARXRBKDM4EL3MBTL1ATM
SCHEMBL17425606 0.91 ATM (0.57) RXRARXRBKDM4EL3MBTL1ATM

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-20210020851-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ORGANIC ELECTROLUMINESCENCE ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2021-01-21 — — US disclosed
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