SCHEMBL24030641

SCHEMBL24030641

c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc4oc5c6cccc7c6c(cc5c34)-c3ccccc3-7)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.37
▸ ALDH1A1 P00352 6/20 0.37
▸ TSHR P16473 5/20 0.37
▸ HSD17B10 Q99714 4/20 0.37
▸ HPGD P15428 3/20 0.37
▸ MAPK1 P28482 3/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ POLB P06746 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ LMNA P02545 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ USP2 O75604 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35

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
SCHEMBL24030607 0.96 ALDH1A1 (0.40) MAPTALDH1A1TSHRHSD17B10HPGD
SCHEMBL24030644 0.94 TSHR (0.36) MAPTALDH1A1TSHRHSD17B10HPGD
SCHEMBL24030912 0.94 ALDH1A1 (0.40) MAPTALDH1A1TSHRHSD17B10HPGD
SCHEMBL24030915 0.93 ALDH1A1 (0.39) MAPTALDH1A1TSHRHSD17B10HPGD
SCHEMBL24030892 0.92 ALOX5 (0.37) MAPTALDH1A1TSHRHSD17B10HPGD
SCHEMBL24030864 0.91 ALDH1A1 (0.38) MAPTALDH1A1TSHRHSD17B10HPGD
SCHEMBL24030603 0.91 ALDH1A1 (0.38) MAPTALDH1A1TSHRHSD17B10HPGD
SCHEMBL24030896 0.91 MAPT (0.38) MAPTALDH1A1TSHRHSD17B10HPGD
SCHEMBL26244224 0.90 MAPT (0.41) MAPTALDH1A1TSHRHSD17B10HPGD
SCHEMBL24030900 0.90 ALDH1A1 (0.40) MAPTALDH1A1TSHRHSD17B10HPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023113577-A1 COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-06-22 — — WO disclosed
WO-2021230690-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-11-18 — — WO disclosed
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