SCHEMBL25639810

SCHEMBL25639810

c1ccc(N(c2ccc3oc4ccccc4c3c2)c2cccc3sc4ccc5c(oc6ccc7ccccc7c65)c4c23)cc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ HSD17B10 Q99714 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
SCHEMBL25639802 0.96 TDP1 (0.32) TDP1L3MBTL1
SCHEMBL25639976 0.92 CYP1A1 (0.31) TDP1L3MBTL1KDM4EGLAMAPT
SCHEMBL25639821 0.92 CYP1A1 (0.31) —
SCHEMBL25639840 0.92 MMP12 (0.31) TDP1L3MBTL1
SCHEMBL25639808 0.91 CYP1A1 (0.31) MAPTHPGD
SCHEMBL25639785 0.91 ABCG2 (0.32) TDP1L3MBTL1KDM4E
SCHEMBL25640759 0.90 TDP1 (0.32) TDP1L3MBTL1KDM4EGLAMAPT
SCHEMBL25639897 0.90 LMNA (0.31) —
SCHEMBL25640527 0.88 TDP1 (0.34) TDP1L3MBTL1KDM4EGLAMAPT
SCHEMBL25639786 0.88 ABCG2 (0.34) —

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-2023113334-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DIODE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-06-22 — — WO disclosed
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