SCHEMBL23028845

SCHEMBL23028845

c1ccc(-c2ccc(-c3cc4c5c(c3)Oc3ccccc3C5(c3ccccc3)c3ccccc3O4)c3ccccc23)cc1

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.32
HTT P42858 2/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
METAP2 P50579 1/20 0.31
CHRNA1 P02708 1/20 0.31
CHRNG P07510 1/20 0.31
CHRNB1 P11230 1/20 0.31
CHRNB2 P17787 1/20 0.31
SLC6A2 P23975 1/20 0.31
CHRNB4 P30926 1/20 0.31
SLC6A4 P31645 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
SLC6A3 Q01959 1/20 0.31
CHRND Q07001 1/20 0.31

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
SCHEMBL23028844 0.85 LMNA (0.33) HTTHPGD
SCHEMBL23028720 0.83 CHRNA1 (0.36) HPGDMAPK1SMN1; SMN2CHRNA1CHRNG
SCHEMBL22706627 0.80 GPR84 (0.33) GPR84
SCHEMBL23028846 0.79 BRDT (0.34)
SCHEMBL22706162 0.79 GPR84 (0.32) GPR84CHRNA1CHRNGCHRNB1CHRNB2
SCHEMBL23028801 0.79 L3MBTL1 (0.37) HTTHPGDMAPK1SMN1; SMN2
SCHEMBL23028855 0.78 BACE1 (0.36) HTTHPGD
SCHEMBL22707538 0.78 CHRNA1 (0.32) GPR84CHRNA1CHRNGCHRNB1CHRNB2
SCHEMBL22706265 0.78 CHRNA1 (0.32) GPR84HPGDCHRNA1CHRNGCHRNB1
SCHEMBL25867637 0.78 MEN1 (0.36) HTTHPGDSMN1; SMN2

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
WO-2021034089-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-25 WO disclosed