SCHEMBL16248492

SCHEMBL16248492

CCC(CO)(CO)COC(=O)c1ccccc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.51
TSHR P16473 7/20 0.50
MAPK1 P28482 3/20 0.47
HIF1A Q16665 1/20 0.47
TDP1 Q9NUW8 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
CYP3A4 P08684 3/20 0.44
TP53 P04637 1/20 0.44
LMNA P02545 1/20 0.43
ALOX15 P16050 1/20 0.42
CA2 P00918 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
NPC1 O15118 1/20 0.39

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
SCHEMBL28439910 0.92 ALDH1A1 (0.56) ALDH1A1TSHRMAPK1HIF1ATDP1
Adipic Acid SCHEMBL6710037 0.92 ALDH1A1 (0.44) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL8423222 0.91 ALDH1A1 (0.57) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL30477175 0.89 ALDH1A1 (0.53) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL21561621 0.86 MAPT (0.44) ALDH1A1TSHRMAPK1HIF1ALMNA
SCHEMBL13497558 0.86 ALDH1A1 (0.47) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL22979070 0.84 TSHR (0.53) ALDH1A1TSHRMAPK1HIF1ATDP1
SCHEMBL21561618 0.84 MAPT (0.42) ALDH1A1TSHRMAPK1HIF1ALMNA
Phthalic Acid SCHEMBL11223424 0.84 ALDH1A1 (0.56) ALDH1A1TSHRTDP1ALOX15CA2
Phthalic Acid SCHEMBL9042493 0.84 ALDH1A1 (0.56) ALDH1A1TSHRTDP1ALOX15CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2810784-A1 RESIN COMPOSITION FOR LASER-ENGRAVABLE FLEXOGRAPHIC PRINTING PLATE, ORIGINAL PLATE FOR LASER-ENGRAVABLE FLEXOGRAPHIC PRINTING PLATE AND METHOD FOR PRODUCTION THEREOF, AND FLEXOGRAPHIC PRINTING PLATE AND METHOD FOR PRODUCTION THEREOF Fujifilm Corporation (JP) 2014-12-10 EP disclosed
US-20140338550-A1 RESIN COMPOSITION FOR LASER-ENGRAVABLE FLEXOGRAPHIC PRINTING PLATE, FLEXOGRAPHIC PRINTING PLATE PRECURSOR FOR LASER-ENGRAVABLE AND PROCESS FOR PRODUCING SAME, AND FLEXOGRAPHIC PRINTING PLATE AND PROCESS FOR MAKING SAME FUJIFILM CORPORATION (JP) 2014-11-20 US disclosed
US-20140338550-A1 RESIN COMPOSITION FOR LASER-ENGRAVABLE FLEXOGRAPHIC PRINTING PLATE, FLEXOGRAPHIC PRINTING PLATE PRECURSOR FOR LASER-ENGRAVABLE AND PROCESS FOR PRODUCING SAME, AND FLEXOGRAPHIC PRINTING PLATE AND PROCESS FOR MAKING SAME FUJIFILM CORPORATION (JP) 2014-11-20 US disclosed