SCHEMBL24628013

SCHEMBL24628013

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5ccc6c7ccccc7c7cccc8oc5c6c87)cc4)c3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 4/20 0.40
ALDH1A1 P00352 4/20 0.40
HPGD P15428 4/20 0.40
KDM4E B2RXH2 3/20 0.40
LMNA P02545 2/20 0.40
NTSR1 P30989 1/20 0.38
GLA P06280 1/20 0.37
CDC14B O60729 1/20 0.36
CDC14A Q9UNH5 1/20 0.36
PLA2G2A P14555 2/20 0.36
PLA2G4A P47712 2/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
ACACA Q13085 2/20 0.35
ALOX5 P09917 1/20 0.35
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL24628528 0.94 MEN1 (0.42) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24628071 0.93 MAPT (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24628577 0.93 MAPT (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24628533 0.87 MEN1 (0.45) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24628546 0.86 ALOX5 (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24628524 0.86 KMT2A (0.38) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23730905 0.85 MAPT (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24628811 0.85 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24628573 0.85 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24628293 0.84 MAPT (0.41) MEN1KMT2AMAPTALDH1A1HPGD

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