SCHEMBL9685964

SCHEMBL9685964

CC(=O)OCc1cccc2c(COC(C)=O)c(C)ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 4/20 0.41
RAD52 P43351 1/20 0.40
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
ELANE P08246 1/20 0.36
PDE10A Q9Y233 1/20 0.35
MEN1 O00255 1/20 0.35
GLA P06280 1/20 0.35
STING1 Q86WV6 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.34
EPHX1 P07099 1/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL9685109 0.85 ALDH1A1 (0.53) KDM4EHSD17B10MAPTL3MBTL1ALDH1A1
SCHEMBL11949302 0.81 ALDH1A1 (0.50) KDM4EHSD17B10MAPTL3MBTL1ALDH1A1
SCHEMBL605494 0.78 ALDH1A1 (0.53) KDM4EHSD17B10ALDH1A1RAD52KMT2A
SCHEMBL29853925 0.76 ALDH1A1 (0.61) KDM4EHSD17B10MAPTL3MBTL1ALDH1A1
SCHEMBL4647196 0.76 ALDH1A1 (0.61) KDM4EHSD17B10MAPTL3MBTL1ALDH1A1
SCHEMBL487420 0.76 KMT2A (0.55) KDM4EHSD17B10L3MBTL1ALDH1A1KMT2A
SCHEMBL11321760 0.74 ALDH1A1 (0.42) KDM4EHSD17B10MAPTL3MBTL1ALDH1A1
SCHEMBL3677313 0.74 KDM4E (0.52) KDM4EHSD17B10MAPTL3MBTL1ALDH1A1
SCHEMBL606744 0.73 ALDH1A1 (0.52) KDM4EHSD17B10MAPTL3MBTL1ALDH1A1
SCHEMBL30417552 0.73 ALDH1A1 (0.57) KDM4EHSD17B10MAPTL3MBTL1ALDH1A1

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-5122442-A Water soluble binder; photosensitive compound HOECHST CELANESE CORPORATION (US) 1992-06-16 US disclosed
EP-0212482-B1 PROCESS FOR OBTAINING NEGATIVE IMAGES FROM POSITIVE PHOTORESISTS HOECHST CELANESE CORPORATION (US) 1989-04-19 EP disclosed
EP-0212482-A2 Process for obtaining negative images from positive photoresists HOECHST CELANESE CORPORATION (US) 1987-03-04 EP disclosed
US-4436804-A Light-sensitive polymeric diazonium condensates and reproduction compositions and materials therewith AMERICAN HOECHST CORPORATION (US) 1984-03-13 US disclosed