SCHEMBL7540212

SCHEMBL7540212

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

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.61
LMNA P02545 5/20 0.48
ALDH1A1 P00352 2/20 0.48
RECQL P46063 1/20 0.48
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.40
CA12 O43570 1/20 0.39
CA14 Q9ULX7 1/20 0.39
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GLA P06280 1/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
EPHX2 P34913 1/20 0.38
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37

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
SCHEMBL14975 0.83 TSHR (0.88) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL27953228 0.83 TSHR (0.88) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL759135 0.82 TSHR (0.52) TSHRLMNAALDH1A1RECQLKMT2A
Ethylene Glycol SCHEMBL27880739 0.80 TSHR (0.74) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL3503548 0.80 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL8076331 0.80 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL1286873 0.80 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
Dimethyl Succinate SCHEMBL8829301 0.80 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
Hydrochloric Acid SCHEMBL21436145 0.80 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A
SCHEMBL118000 0.80 TSHR (0.82) TSHRLMNAALDH1A1RECQLKMT2A

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