SCHEMBL22136017

SCHEMBL22136017

Nc1ccc2ccc3ccc(-c4ccccc4)nc3c2n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 2/20 0.59
PARP1 P09874 1/20 0.51
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
RAB9A P51151 2/20 0.46
BACE1 P56817 3/20 0.46
ADORA2A P29274 3/20 0.46
ADORA1 P30542 2/20 0.46
NCF1 P14598 2/20 0.46
PLAU P00749 1/20 0.46
AURKA O14965 1/20 0.46
HSP90AA1 P07900 1/20 0.46
PRKACA P17612 1/20 0.46
MAP2K3 P46734 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 2/20 0.42
NOS2 P35228 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GMNN O75496 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL31432891 1.00 ASIC3 (0.59) ASIC3PARP1MEN1KMT2ARAB9A
SCHEMBL1753930 0.87 MEN1 (0.59) ASIC3PARP1MEN1KMT2ARAB9A
SCHEMBL29441293 0.87 MEN1 (0.59) ASIC3PARP1MEN1KMT2ARAB9A
SCHEMBL17899333 0.85 MEN1 (0.56) ASIC3PARP1MEN1KMT2ARAB9A
SCHEMBL30870477 0.85 MEN1 (0.56) ASIC3PARP1MEN1KMT2ARAB9A
SCHEMBL10032304 0.85 MEN1 (0.56) ASIC3PARP1MEN1KMT2ARAB9A
SCHEMBL30870479 0.85 MEN1 (0.56) ASIC3PARP1MEN1KMT2ARAB9A
SCHEMBL20250404 0.83 MEN1 (0.54) ASIC3PARP1MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL4387023 0.83 RAB9A (0.54) ASIC3PARP1MEN1KMT2ARAB9A
SCHEMBL30595380 0.83 MEN1 (0.54) ASIC3PARP1MEN1KMT2ARAB9A

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
WO-2021116225-A1 ACRIDINE COMPOUND AND ORGANIC SEMICONDUCTING LAYER, ORGANIC ELECTRONIC DEVICE AND DISPLAY DEVICE COMPRISING THE SAME NOVALED GMBH (DE) 2021-06-17 WO disclosed
WO-2020130553-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 두산솔루스 주식회사 2020-06-25 WO disclosed