SCHEMBL30914218

SCHEMBL30914218

Oc1nc2ccccc2c2c(Cl)cccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
CLK1 P49759 1/20 0.43
CDK9 P50750 1/20 0.43
CDK5 Q00535 1/20 0.43
DYRK1A Q13627 1/20 0.43
DYRK2 Q92630 1/20 0.43
CLK4 Q9HAZ1 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
CYP1A2 P05177 3/20 0.42
CYP2A6 P11509 2/20 0.42
GUSB P08236 2/20 0.41
PARP1 P09874 1/20 0.40
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
IDO2 Q6ZQW0 1/20 0.40
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
C1R P00736 2/20 0.39
BCHE P06276 1/20 0.39

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
SCHEMBL28475918 1.00 MAOA (0.45) MAOAMAOBCLK1CDK9CDK5
SCHEMBL7558381 0.85 MAOA (0.45) MAOAMAOBCLK1CDK9CDK5
Hydrochloric Acid SCHEMBL28478238 0.76 PDE7A (0.40) CYP1A2PARP1KMT2AMEN1C1R
Hydrochloric Acid SCHEMBL30914216 0.76 PDE7A (0.40) CYP1A2PARP1KMT2AMEN1C1R
SCHEMBL7607540 0.73 GPR3 (0.54) MAOAMAOBCYP1A2KMT2ADHODH
SCHEMBL6706992 0.73 PDE3B (0.46) MAOAMAOBCLK1CDK9CDK5
SCHEMBL10654059 0.73 MAOA (0.65) MAOAMAOBCLK1CDK9CDK5
SCHEMBL28961139 0.72 MAOA (0.64) MAOAMAOBCYP1A2KMT2AMEN1
SCHEMBL4058577 0.72 MAOA (0.52) MAOAMAOBCYP1A2KMT2AMEN1
SCHEMBL30170473 0.72 MAOA (0.52) MAOAMAOBCYP1A2KMT2AMEN1

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-111867634-B Enhancement of translocation of micro/nanoparticles across mucus layers using alginate oligomers 阿尔吉法玛公司 2024-06-11 CN disclosed