SCHEMBL23028832

SCHEMBL23028832

c1ccc(-c2nc3ccccc3nc2-c2ccc(C34c5ccccc5Sc5cccc(c53)-c3ccccc34)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.40
KDM4E B2RXH2 10/20 0.40
LMNA P02545 6/20 0.40
GAA P10253 3/20 0.40
KMT2A Q03164 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
MEN1 O00255 2/20 0.40
AKT1 P31749 2/20 0.39
AKT2 P31751 1/20 0.39
ALDH1A1 P00352 6/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ATM Q13315 1/20 0.35
TLR9 Q9NR96 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
PKM P14618 1/20 0.35
MAPT P10636 1/20 0.35
OPRK1 P41145 1/20 0.35
THRB P10828 1/20 0.35
NPC1 O15118 1/20 0.33
HPGD P15428 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
SCHEMBL23028824 0.87 MEN1 (0.42) KDM4ELMNAKMT2ATDP1MEN1
SCHEMBL23028825 0.86 MEN1 (0.47) KDM4EGAAKMT2AMEN1ALDH1A1
SCHEMBL23028831 0.86 MEN1 (0.41) L3MBTL1KDM4ELMNAKMT2AMEN1
SCHEMBL23814650 0.84 L3MBTL1 (0.41) L3MBTL1KDM4ELMNAGAAKMT2A
SCHEMBL23028828 0.81 MEN1 (0.41) KDM4ELMNAGAAKMT2ATDP1
SCHEMBL23028823 0.81 MEN1 (0.43) L3MBTL1KDM4ELMNAGAAKMT2A
SCHEMBL23028804 0.79 TDP1 (0.41) L3MBTL1KDM4ELMNAGAAKMT2A
SCHEMBL23028826 0.79 KDM4E (0.36) KDM4ELMNAKMT2AMEN1SMN1; SMN2
SCHEMBL21151564 0.76 MEN1 (0.43) L3MBTL1KDM4ELMNAGAAKMT2A
SCHEMBL23028806 0.76 MEN1 (0.33) KDM4ELMNAGAAKMT2ATDP1

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-2021034089-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-25 WO disclosed