SCHEMBL23486990

SCHEMBL23486990

c1ccc(-c2nc3ccccc3nc2-c2cc3cccc4c5ccccc5n5c6ccccc6c6sc2c(c34)c65)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.38
KDM4E B2RXH2 7/20 0.36
ALDH1A1 P00352 5/20 0.36
LMNA P02545 4/20 0.36
GAA P10253 3/20 0.36
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP1A2 P05177 1/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 3/20 0.33
MAPK1 P28482 2/20 0.33
TSHR P16473 1/20 0.33
CASP1 P29466 1/20 0.33
HIF1A Q16665 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
MAPT P10636 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL23487162 0.83 L3MBTL1 (0.38) L3MBTL1KDM4EALDH1A1LMNAGAA
SCHEMBL23486984 0.82 TSHR (0.32) L3MBTL1KDM4EALDH1A1HSD17B10SMN1; SMN2
SCHEMBL23486983 0.81 TSHR (0.36) L3MBTL1KDM4EALDH1A1HSD17B10SMN1; SMN2
SCHEMBL23487168 0.80 L3MBTL1 (0.36) L3MBTL1KDM4EALDH1A1LMNAGAA
SCHEMBL23486991 0.79 ALDH1A1 (0.30) L3MBTL1ALDH1A1HSD17B10HPGDMAPK1
SCHEMBL23487170 0.78 TDP1 (0.35) L3MBTL1KDM4EALDH1A1LMNAGAA
SCHEMBL23487191 0.77 MEN1 (0.36) L3MBTL1KDM4EALDH1A1LMNAGAA
SCHEMBL22722251 0.75 KDM4E (0.41) L3MBTL1KDM4EALDH1A1LMNAGAA
SCHEMBL23486941 0.74 CYP1A2 (0.34) L3MBTL1ALDH1A1HSD17B10CYP1A2HPGD
SCHEMBL22954848 0.73 MEN1 (0.39) L3MBTL1KDM4EALDH1A1LMNAGAA

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-2021112478-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-06-10 WO disclosed