SCHEMBL24628533

SCHEMBL24628533

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)c4cccc6oc7cccc5c7c64)c3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.45
KMT2A Q03164 8/20 0.45
ALDH1A1 P00352 7/20 0.45
HPGD P15428 7/20 0.45
MAPT P10636 6/20 0.45
KDM4E B2RXH2 4/20 0.45
LMNA P02545 2/20 0.45
NTSR1 P30989 1/20 0.44
GLA P06280 1/20 0.42
PLA2G2A P14555 3/20 0.41
PLA2G4A P47712 3/20 0.41
PLA2G10 O15496 1/20 0.41
ADORA2A P29274 2/20 0.38
ADORA1 P30542 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
CYP2C19 P33261 1/20 0.37
ACHE P22303 1/20 0.36

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
SCHEMBL24628573 0.94 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL24628811 0.94 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL24628918 0.94 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL24628082 0.91 PLA2G2A (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL24628541 0.91 PLA2G2A (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL24628571 0.91 PLA2G2A (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22097226 0.91 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL24628530 0.90 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22096939 0.90 KMT2A (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL21186974 0.90 MAPT (0.40) MEN1KMT2AALDH1A1HPGDMAPT

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
WO-2022148717-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-07-14 WO disclosed