SCHEMBL9615549

SCHEMBL9615549

C=C(C)C(=O)OCC(CC)(COC(=O)C(=C)C)COC(=O)c1ccccc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.47
TSHR P16473 7/20 0.45
MAPK1 P28482 3/20 0.43
HIF1A Q16665 1/20 0.43
TDP1 Q9NUW8 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP3A4 P08684 3/20 0.40
TP53 P04637 1/20 0.40
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.37
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
NPC1 O15118 1/20 0.36

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
SCHEMBL9615563 0.94 ALDH1A1 (0.49) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL9615570 0.90 MAPK1 (0.39) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL9615548 0.88 ALDH1A1 (0.48) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL28439910 0.87 ALDH1A1 (0.56) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL9172153 0.85 MAPK1 (0.63) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL30477175 0.84 ALDH1A1 (0.53) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL13415067 0.83 MAPK1 (0.45) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL16248492 0.83 ALDH1A1 (0.51) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL16243474 0.83 MAPK1 (0.45) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL9615553 0.83 MAPK1 (0.42) ALDH1A1TSHRMAPK1HIF1ATDP1

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
US-5096799-A Carboxy grou-containing binder, photoinitiator with lophine dimer, carboxy and ester group-containing compound to prevent discoloration, monomer; storage stable FUJI PHOTO FILM CO., LTD. (JP) 1992-03-17 US disclosed