SCHEMBL22700306

SCHEMBL22700306

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)sc4cccc(-c6cccc(-c7nc(-c8ccccc8)cc(-c8ccccc8)n7)c6)c45)c3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
ALDH1A1 P00352 6/20 0.41
HPGD P15428 6/20 0.41
MAPT P10636 5/20 0.41
KDM4E B2RXH2 3/20 0.41
LMNA P02545 2/20 0.41
NTSR1 P30989 1/20 0.40
GLA P06280 1/20 0.39
LIMK1 P53667 2/20 0.37
MAOB P27338 3/20 0.36
MAOA P21397 2/20 0.36
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PIK3CA P42336 1/20 0.34
PI4KA P42356 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
NPSR1 Q6W5P4 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
SCHEMBL22700293 0.99 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700307 0.96 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329366 0.94 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329726 0.93 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700295 0.92 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700260 0.92 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329360 0.92 MEN1 (0.47) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329357 0.92 MEN1 (0.47) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL19196042 0.92 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329322 0.91 MEN1 (0.43) 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-2020235976-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 (KR) 2020-11-26 WO disclosed