SCHEMBL30833300

SCHEMBL30833300

CCN(CC)Cc1ccc(COc2cccc3[nH]c4ccccc4c23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 5/20 0.46
DNM1 Q05193 2/20 0.45
BCHE P06276 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
SRD5A2 P31213 1/20 0.41
HTR2A P28223 2/20 0.40
CTSV O60911 1/20 0.40
CTSL P07711 1/20 0.40
HRH3 Q9Y5N1 2/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
DRD2 P14416 3/20 0.40
TLR4 O00206 3/20 0.40
KDM4E B2RXH2 1/20 0.40
SLC22A2 O15244 1/20 0.40
SLC22A1 O15245 1/20 0.40
MLNR O43193 1/20 0.40
NR1I2 O75469 1/20 0.40
KCNK2 O95069 1/20 0.40
ABCB11 O95342 1/20 0.40
APP P05067 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
SCHEMBL30833299 0.87 ADRB2 (0.47) ADRB2DNM1BCHESRD5A2HTR2A
SCHEMBL29180926 0.83 ADRB2 (0.50) ADRB2DNM1BCHEL3MBTL1SRD5A2
SCHEMBL4893406 0.82 SRD5A2 (0.56) ADRB2DNM1L3MBTL1SRD5A2HTR2A
SCHEMBL29180951 0.81 ADRB2 (0.48) ADRB2DNM1L3MBTL1SRD5A2CTSV
SCHEMBL29180946 0.81 ADRB2 (0.54) ADRB2DNM1L3MBTL1HTR2ACTSV
SCHEMBL29180915 0.80 ADRB2 (0.47) ADRB2DNM1SRD5A2CTSVCTSL
SCHEMBL29180920 0.80 ADRB2 (0.47) ADRB2DNM1BCHEL3MBTL1SRD5A2
SCHEMBL29180973 0.80 ADRB2 (0.47) ADRB2DNM1BCHESRD5A2HTR2A
SCHEMBL29180941 0.80 ADRB2 (0.52) ADRB2DNM1BCHESRD5A2HTR2A
SCHEMBL29180921 0.77 KIF11 (0.46) ADRB2DNM1SRD5A2ABCG2TLR4

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-117800898-A Carbazole compound and application thereof 中国药科大学 2024-04-02 CN disclosed