SCHEMBL22706141

SCHEMBL22706141

CC1(C)c2ccccc2Oc2c(-c3cccc4c(-c5cccc6ccccc56)c5cccc(-c6cccc7c6Oc6ccccc6C7(C)C)c5cc34)cccc21

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
DRD1 P21728 1/20 0.33
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
DHFR P00374 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL22706628 0.96 GPR84 (0.35) GPR84MAOAMAOBDRD1MEN1
SCHEMBL22707471 0.90 GPR84 (0.33) GPR84MAOAMAOBDRD1ALDH1A1
SCHEMBL22707863 0.90 GPR84 (0.34) GPR84MAOAMAOBDRD1ALDH1A1
SCHEMBL22705964 0.88 GPR84 (0.33) GPR84DRD1MEN1KMT2AKDM4E
SCHEMBL22706912 0.88 DRD1 (0.33) DRD1
SCHEMBL22707095 0.86 DRD1 (0.35) GPR84DRD1
SCHEMBL22706588 0.86 DRD1 (0.32) DRD1
SCHEMBL22706037 0.86 DRD1 (0.36) GPR84DRD1
SCHEMBL22706069 0.86 MAOA (0.34) GPR84MAOAMAOBMEN1MAPT
SCHEMBL22706401 0.85 DRD1 (0.35) GPR84DRD1

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