SCHEMBL22987196

SCHEMBL22987196

c1ccc(-c2nc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)nc(-c3ccc4sc5ccccc5c4c3)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 4/20 0.35
MAPT P10636 4/20 0.35
HPGD P15428 3/20 0.35
PIM3 Q86V86 1/20 0.35
CYP1A2 P05177 1/20 0.34
GPR3 P46089 1/20 0.34
PDK2 Q15119 3/20 0.34
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX5 P09917 1/20 0.33
NTSR1 P30989 1/20 0.33
ROCK1 Q13464 1/20 0.32
ATM Q13315 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
GLA P06280 1/20 0.32
PTPN7 P35236 1/20 0.31

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
SCHEMBL24039843 0.99 MEN1 (0.35) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23437275 0.98 PIM3 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23437793 0.98 PIM3 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23437267 0.98 PIM3 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23032779 0.98 PIM3 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23437157 0.96 PIM3 (0.36) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23437711 0.95 PIM3 (0.37) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23437200 0.95 PIM3 (0.33) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23032787 0.95 PIM3 (0.37) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23437378 0.95 PIM3 (0.37) MEN1KMT2AALDH1A1MAPTHPGD

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-20210050528-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2021-02-18 US disclosed