SCHEMBL28009140

SCHEMBL28009140

Brc1ccc2c(c1)c1cc(-c3ccccn3)ccc1n2-c1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
IRAK4 Q9NWZ3 1/20 0.39
GRM5 P41594 1/20 0.36
MAPT P10636 2/20 0.36
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
PRMT5 O14744 2/20 0.36
WDR77 Q9BQA1 1/20 0.36
COMT P21964 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
DCTPP1 Q9H773 1/20 0.36
NPY5R Q15761 1/20 0.35
CNR2 P34972 1/20 0.35
PIM1 P11309 1/20 0.35
PIM3 Q86V86 1/20 0.35
SLC11A2 P49281 1/20 0.35

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
SCHEMBL28728317 0.89 MEN1 (0.43) MEN1KMT2ANPSR1MAPTUSP2
SCHEMBL28009145 0.88 MEN1 (0.43) MEN1KMT2ANPSR1IRAK4MAPT
SCHEMBL16593083 0.86 HTR1A (0.39) MEN1KMT2ANPSR1IRAK4GRM5
SCHEMBL29853603 0.84 MEN1 (0.43) MEN1KMT2ANPSR1MAPTUSP2
SCHEMBL2730486 0.84 MEN1 (0.43) MEN1KMT2ANPSR1MAPTUSP2
SCHEMBL19533807 0.82 MEN1 (0.48) MEN1KMT2ANPSR1IRAK4MAPT
SCHEMBL28009162 0.82 NPY5R (0.43) MEN1KMT2ANPSR1IRAK4MAPT
SCHEMBL16593107 0.81 METAP2 (0.39) MEN1KMT2AIRAK4GRM5PRMT5
SCHEMBL17228700 0.78 HSD17B1 (0.43) MEN1KMT2AIRAK4GRM5MAPT
SCHEMBL24137222 0.78 ALDH1A1 (0.42) MEN1KMT2ANPSR1IRAK4MAPT

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-104507927-A Cyclic azine compound, method for producing same, and organic electroluminescent element containing same TOSOH CORP 2015-04-08 CN disclosed