SCHEMBL23814744

SCHEMBL23814744

c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cccc(-c5ccc6c(c5)C5(c7cc(-c8cccc(-c9cc(-c%10ccccc%10)nc(-c%10cccc(-c%11ccc%12c(c%11)C%11(c%13ccccc%13O%12)c%12ccccc%12-c%12ccccc%12%11)c%10)n9)c8)ccc7O6)c6ccccc6-c6ccccc65)c4)n3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
MAPT P10636 4/20 0.42
ALDH1A1 P00352 4/20 0.42
HPGD P15428 4/20 0.42
KDM4E B2RXH2 3/20 0.42
LMNA P02545 2/20 0.42
GLA P06280 1/20 0.39
NTSR1 P30989 1/20 0.38
ADORA1 P30542 3/20 0.36
ADORA2A P29274 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
PDK2 Q15119 3/20 0.36
THRB P10828 1/20 0.34
BACE1 P56817 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
AGTR1 P30556 1/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL21677754 1.00 MEN1 (0.42) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL20618953 1.00 MEN1 (0.42) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19298726 1.00 MEN1 (0.42) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21677633 1.00 MEN1 (0.42) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22670411 0.99 MEN1 (0.41) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21477831 0.99 MEN1 (0.41) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19298743 0.99 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19298249 0.99 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19299026 0.99 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19298990 0.99 MEN1 (0.40) 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
US-20210288260-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2021-09-16 US disclosed