SCHEMBL28313136

SCHEMBL28313136

NC1C2CC3CC(C2)CC1(c1ccccc1)C3

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.42
MAOA P21397 9/20 0.42
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
KDM1A O60341 4/20 0.36
CYP2C19 P33261 4/20 0.36
CYP2B6 P20813 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 2/20 0.36
LMNA P02545 2/20 0.36
CYP3A4 P08684 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
CYP2A6 P11509 1/20 0.36

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
SCHEMBL4607913 0.79 P2RX7 (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6687826 0.78 GRIN2D (0.39) MAOBMAOAGRIN2DGRIN3BGRIN1
SCHEMBL28026945 0.77 MAOB (0.40) MAOBMAOAGRIN2DGRIN3BGRIN1
SCHEMBL5561167 0.76 KDM1A (0.38) MAOBMAOAGRIN2DGRIN3BGRIN1
SCHEMBL5475255 0.74 HSD11B1 (0.44) LMNAALDH1A1P2RX7
SCHEMBL27966414 0.74 HSD11B1 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL18642602 0.70 MAOB (0.47) MAOBMAOAGRIN2DGRIN3BGRIN1
SCHEMBL4412220 0.70 GRIN2D (0.50) MAOBMAOAGRIN2DGRIN3BGRIN1
SCHEMBL21002245 0.70 CNR2 (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6683935 0.70 GRIN2D (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
CN-110028459-A Compound, display panel and display device 上海天马有机发光显示技术有限公司 2019-07-19 CN disclosed