SCHEMBL10716248

SCHEMBL10716248

CCC(C(=O)OC(=O)C(C)c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49
LMNA P02545 3/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
HTT P42858 2/20 0.47
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
RECQL P46063 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL2222145 0.91 GAA (0.55) KDM4EGAALMNAHSD17B10MEN1
SCHEMBL5692490 0.86 KMT2A (0.52) LMNAKMT2AL3MBTL1
SCHEMBL8995858 0.83 GAA (0.51) KDM4EGAALMNAHSD17B10MEN1
SCHEMBL11030697 0.81 MEN1 (0.50) KDM4EGAALMNAHSD17B10MEN1
SCHEMBL5692495 0.81 CYP1A2 (0.45) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL28645163 0.80 GAA (0.55) KDM4EGAALMNAHSD17B10MEN1
SCHEMBL27693696 0.80 LMNA (0.51) KDM4EGAALMNAHSD17B10MEN1
SCHEMBL8076620 0.80 KDM4E (0.49) KDM4EGAALMNAHSD17B10MEN1
SCHEMBL29024339 0.79 KDM4E (0.51) KDM4EGAALMNAHSD17B10MEN1
SCHEMBL2290954 0.79 CRHBP (0.53) KDM4EGAALMNAHSD17B10MEN1

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
EP-0126216-B1 HYDROXY-T-ALKYL PEROXYESTER PENNWALT CORPORATION (US) 1987-04-08 EP disclosed
US-4634753-A CATALYTIC POLYMERIZATION OF UNSATURATED MONOMERS AND CURING UNSATURATED POLYESTERS PENNWALT CORPORATION (US) 1987-01-06 US disclosed
US-4525308-A POLYMERIZATION CATALYST, CURING AGENT PENNWALT CORPORATION (US) 1985-06-25 US disclosed
EP-0126216-A2 Hydroxy-t-alkyl peroxyester PENNWALT CORPORATION (US) 1984-11-28 EP disclosed