SCHEMBL29623029

SCHEMBL29623029

N#Cc1ccc2c(c1)oc1c(Br)cccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.40
▸ TDO2 P48775 1/20 0.38
▸ LOXL2 Q9Y4K0 1/20 0.36
▸ DYRK1A Q13627 2/20 0.36
▸ TNKS O95271 1/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ ROCK2 O75116 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ MAOB P27338 2/20 0.34
▸ CXCR1 P25024 1/20 0.33
▸ CXCR2 P25025 1/20 0.33
▸ NOS3 P29474 1/20 0.33
▸ NOS1 P29475 1/20 0.33
▸ NOS2 P35228 1/20 0.33
▸ AR P10275 1/20 0.33
▸ CYP2A6 P11509 1/20 0.33
▸ ADRB2 P07550 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL13564568 0.83 IDO1 (0.42) IDO1TDO2DYRK1ATNKSCA1
SCHEMBL31672685 0.81 IDO1 (0.50) IDO1TDO2DYRK1ATNKSCA1
SCHEMBL18347519 0.81 IDO1 (0.46) IDO1TDO2DYRK1ATNKSCA1
SCHEMBL22315719 0.81 IDO1 (0.50) IDO1TDO2DYRK1ATNKSCA1
SCHEMBL31355175 0.79 IDO1 (0.48) IDO1TDO2DYRK1ATNKSCA1
SCHEMBL3879946 0.78 LOXL2 (0.41) LOXL2DYRK1ATNKS
SCHEMBL30829289 0.78 LOXL2 (0.41) LOXL2DYRK1ATNKS
SCHEMBL22892596 0.78 AHR (0.48) IDO1LOXL2DYRK1ATNKS
SCHEMBL548396 0.77 IDO1 (0.45) IDO1TDO2TNKSCA1CA2
SCHEMBL3086890 0.76 AHR (0.53) IDO1TDO2TNKSCA1CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114437137-B Organic metal compound, organic electroluminescent device and application 吉林奥来德光电材料股份有限公司 2023-12-05 — — CN disclosed
CN-114437137-A Organic metal compound, organic electroluminescent device and application 吉林奥来德光电材料股份有限公司 2022-05-06 — — CN disclosed
Send feedback