SCHEMBL27456041

SCHEMBL27456041

c1ccc(-c2nc(-c3ccc(-c4ccccc4)c4ccccc34)nc(-c3ccc(-c4cccc5ccccc45)c4ccccc34)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.54
▸ SMN1; SMN2 Q16637 4/20 0.54
▸ KDM4E B2RXH2 4/20 0.54
▸ ALDH1A1 P00352 4/20 0.54
▸ HPGD P15428 4/20 0.54
▸ TSHR P16473 2/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ TP53 P04637 1/20 0.54
▸ NFKB1 P19838 1/20 0.54
▸ NFKB2 Q00653 1/20 0.54
▸ RELA Q04206 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ TNF P01375 1/20 0.50
▸ HDAC8 Q9BY41 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.44
▸ ALOX15 P16050 1/20 0.44

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
SCHEMBL25668527 1.00 MAPT (0.54) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL27129092 0.98 MAPT (0.53) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL23633622 0.98 MAPT (0.56) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL25668530 0.98 MAPT (0.56) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL27129094 0.97 TSHR (0.51) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL25668538 0.96 MAPT (0.54) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL27129012 0.96 MAPT (0.54) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL27456357 0.96 MAPT (0.57) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL25682926 0.96 MAPT (0.57) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL27129093 0.95 TSHR (0.50) MAPTSMN1; SMN2KDM4EALDH1A1HPGD

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-2024143905-A1 ORGANIC ELECTRIC ELEMENT USING ORGANIC ELECTRIC ELEMENT COMPOUND, AND ELECTRONIC DEVICE 덕산네오룩스 주식회사 2024-07-04 — — WO disclosed
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