SCHEMBL21478041

SCHEMBL21478041

c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6O5)c5ccccc5C5(c6ccccc6-c6ccccc65)c5ccccc54)cc3)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.42
KMT2A Q03164 7/20 0.42
MAPT P10636 6/20 0.42
ALDH1A1 P00352 5/20 0.42
HPGD P15428 5/20 0.42
NTSR1 P30989 1/20 0.42
KDM4E B2RXH2 3/20 0.38
LMNA P02545 2/20 0.38
GLA P06280 1/20 0.38
PDK2 Q15119 1/20 0.37
ADORA2A P29274 3/20 0.37
ADORA1 P30542 3/20 0.37
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAOB P27338 3/20 0.35
MAOA P21397 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
THRB P10828 1/20 0.35
BACE1 P56817 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
SCHEMBL19299008 0.99 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19299305 0.99 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19298620 0.99 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22672075 0.99 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL20618952 0.99 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL20622578 0.99 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL20622575 0.99 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL20618890 0.99 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19299023 0.99 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19298992 0.96 MEN1 (0.43) 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-2019199068-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2019-10-17 WO disclosed