SCHEMBL7538601

SCHEMBL7538601

CC(O)COC(C)CO.COC(=O)CCCCC(=O)OC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
MAPT P10636 2/20 0.45
LMNA P02545 3/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
DUSP3 P51452 1/20 0.39
MEN1 O00255 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
RECQL P46063 1/20 0.35
MAPK1 P28482 1/20 0.35
PRKCA P17252 1/20 0.34
PRKCE Q02156 1/20 0.34
PRKCQ Q04759 1/20 0.34
PRKCD Q05655 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
SCHEMBL3733099 0.93 TSHR (0.44) TSHRMAPTLMNAALDH1A1KMT2A
SCHEMBL3726886 0.91 TSHR (0.41) TSHRMAPTLMNAALDH1A1KMT2A
SCHEMBL29268609 0.85 TSHR (0.45) TSHRMAPTLMNAALDH1A1KMT2A
SCHEMBL29088151 0.84 TDP1 (0.42) TSHRMAPTLMNAKMT2AKDM4E
SCHEMBL7535238 0.83 MAPT (0.54) TSHRMAPTLMNAALDH1A1KMT2A
SCHEMBL10172791 0.82 TSHR (0.50) TSHRMAPTLMNAALDH1A1KMT2A
Adipic Acid SCHEMBL4595421 0.82 LMNA (0.41) TSHRMAPTLMNAALDH1A1KMT2A
Acetic Acid Methyl Ester SCHEMBL419369 0.82 TDP1 (0.41) TSHRMAPTALDH1A1TDP1MAPK1
Propylene Glycol SCHEMBL28906594 0.81 TSHR (0.58) TSHRMAPTLMNAALDH1A1KMT2A
SCHEMBL28712009 0.81 MAPT (0.59) MAPTLMNAALDH1A1KMT2AKDM4E

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-0452509-B9 USE OF SYNTHETIC LUBRICATING OIL BASED ON POLYESTER AS LUBRICANT IN REFRIGERATORS IDEMITSU KOSAN CO (JP) 2002-05-08 EP disclosed
EP-0452509-B1 USE OF SYNTHETIC LUBRICATING OIL BASED ON POLYESTER AS LUBRICANT IN REFRIGERATORS IDEMITSU KOSAN CO (JP) 1994-07-06 EP disclosed
EP-0452509-A1 USE OF SYNTHETIC LUBRICATING OIL BASED ON POLYESTER AS LUBRICANT IN REFRIGERATORS IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-10-23 EP disclosed