SCHEMBL22694265

SCHEMBL22694265

O=C1OC(=O)c2cc3c(cc21)CC3

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
ALOX15 P16050 1/20 0.46
CDC25B P30305 1/20 0.42
ALDH1A1 P00352 1/20 0.39
CES1 P23141 1/20 0.39
TYMS P04818 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.32
PBRM1 Q86U86 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP2A6 P11509 1/20 0.32
TSHR P16473 1/20 0.32
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 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
SCHEMBL23379742 1.00 TDP1 (0.46) TDP1ALOX15CDC25BALDH1A1CES1
SCHEMBL23379738 0.93 CDC25B (0.48) TDP1ALOX15CDC25BALDH1A1CES1
SCHEMBL4115275 0.90 CDC25B (0.56) TDP1ALOX15CDC25BALDH1A1CES1
SCHEMBL23379780 0.90 CDC25B (0.50) TDP1ALOX15CDC25BALDH1A1CES1
SCHEMBL4110777 0.90 CDC25B (0.50) TDP1ALOX15CDC25BALDH1A1CES1
SCHEMBL16744282 0.83 ALOX15 (0.46) TDP1ALOX15CDC25BALDH1A1CES1
SCHEMBL9308993 0.80 ALOX15 (0.34) TDP1ALOX15CDC25BALDH1A1
SCHEMBL4110804 0.79 ALOX15 (0.42) TDP1ALOX15CDC25BALDH1A1TYMS
SCHEMBL3993249 0.78 TDP1 (0.59) TDP1ALOX15CDC25BALDH1A1TYMS
SCHEMBL14538944 0.77 ALOX15 (0.40) TDP1ALOX15ALDH1A1TYMSMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018127-B2 Additive manufacturing of aromatic thermoplastics from photocurable precursor salts VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2024-06-25 US disclosed
US-12018127-B2 Additive manufacturing of aromatic thermoplastics from photocurable precursor salts VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2024-06-25 US disclosed
US-20210115279-A1 ADDITIVE MANUFACTURING OF AROMATIC THERMOPLASTICS FROM PHOTOCURABLE PRECURSOR SALTS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2021-04-22 US disclosed
US-20200369831-A1 ADDITIVE MANUFACTURING OF AROMATIC THERMOPLASTICS FROM PHOTOCURABLE PRECURSOR SALTS VIRGINIA POLYTECHNIC INSTITUTE AND STATE UNIVERSITY 2020-11-26 US disclosed