SCHEMBL29613809

SCHEMBL29613809

O=C(Oc1cccc2ccccc12)c1cccc(C(=O)Oc2cccc3ccccc23)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.71
PTGES O14684 1/20 0.64
KMT2A Q03164 7/20 0.59
HSD17B10 Q99714 4/20 0.59
MAPT P10636 4/20 0.58
MEN1 O00255 3/20 0.58
GAA P10253 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
ESR1 P03372 2/20 0.58
ESR2 Q92731 2/20 0.58
JAK2 O60674 1/20 0.58
USP2 O75604 1/20 0.58
ALOX15 P16050 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
ALDH1A1 P00352 3/20 0.56
PGR P06401 1/20 0.56
PTGS1 P23219 1/20 0.56
MAPK1 P28482 1/20 0.56
POLB P06746 2/20 0.55
MMP2 P08253 1/20 0.55

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
SCHEMBL5081762 1.00 ALOX5 (0.71) ALOX5PTGESKMT2AHSD17B10MAPT
SCHEMBL27059849 0.95 ALOX5 (0.70) ALOX5PTGESKMT2AHSD17B10MAPT
SCHEMBL15153930 0.94 ALOX5 (0.64) ALOX5PTGESKMT2AHSD17B10MAPT
SCHEMBL21348370 0.92 ALOX5 (0.63) ALOX5PTGESKMT2AHSD17B10MAPT
SCHEMBL22202246 0.92 ALOX5 (0.63) ALOX5PTGESKMT2AHSD17B10MAPT
SCHEMBL10921870 0.92 ALOX5 (0.66) ALOX5PTGESKMT2AHSD17B10MAPT
SCHEMBL2477732 0.91 KMT2A (0.70) ALOX5PTGESKMT2AHSD17B10MAPT
SCHEMBL30874080 0.91 KMT2A (0.70) ALOX5PTGESKMT2AHSD17B10MAPT
SCHEMBL27267214 0.89 ALOX5 (0.60) ALOX5PTGESKMT2AHSD17B10MAPT
SCHEMBL1043660 0.89 ALOX5 (0.63) ALOX5PTGESKMT2AHSD17B10MAPT

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
CN-110799483-B Active ester compound and curable composition DIC株式会社 2023-04-14 CN disclosed
CN-110831921-B Active ester compound and curable composition DIC株式会社 2022-09-13 CN disclosed