SCHEMBL8018291

SCHEMBL8018291

CCCCOC(=O)CC.CCCOC(=O)CC

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.75
ALDH1A1 P00352 1/20 0.56
ATM Q13315 1/20 0.52
DGKA P23743 1/20 0.50
HTT P42858 1/20 0.49
TSHR P16473 4/20 0.48
HPGD P15428 1/20 0.48
RAD52 P43351 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
FAAH O00519 1/20 0.46
DNM1 Q05193 1/20 0.46
HCAR2 Q8TDS4 1/20 0.45
HTR2C P28335 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
EPHX1 P07099 1/20 0.42
LMNA P02545 1/20 0.41
ESR1 P03372 1/20 0.41

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
SCHEMBL28562463 0.95 NAAA (0.82) NAAAALDH1A1ATMDGKAHTT
SCHEMBL26794 0.95
Hydrochloric Acid SCHEMBL28177992 0.93 NAAA (0.78) NAAAALDH1A1ATMDGKAHTT
Water SCHEMBL27611718 0.93 NAAA (0.78) NAAAALDH1A1ATMDGKAHTT
Fluoride SCHEMBL27853779 0.93 NAAA (0.78) NAAAALDH1A1ATMDGKAHTT
Ammonia Solution, Strong SCHEMBL23711256 0.93 NAAA (0.78) NAAAALDH1A1ATMDGKAHTT
Ethane SCHEMBL28195545 0.93 NAAA (0.78) NAAAALDH1A1ATMDGKAHTT
Acetic Acid Butyl Ester SCHEMBL28048454 0.92 ALDH1A1 (0.72) NAAAALDH1A1ATMDGKAHTT
SCHEMBL15987915 0.91 NAAA (0.91) NAAAALDH1A1ATMDGKAHTT
SCHEMBL28285990 0.91 NAAA (0.83) NAAAALDH1A1DGKAHTTTSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117691184-A Electrolyte additive, electrolyte and battery 广州天赐高新材料股份有限公司 2024-03-12 CN claimed
CN-117691184-A Electrolyte additive, electrolyte and battery 广州天赐高新材料股份有限公司 2024-03-12 CN disclosed
US-20230238579-A1 NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY MURATA MANUFACTURING CO., LTD. (JP) 2023-07-27 US disclosed
WO-2019182035-A1 METHOD FOR PRODUCING AROMATIC HYDROXY COMPOUND 宇部興産株式会社 2019-09-26 WO disclosed
EP-0973930-A1 HIGH TEMPERATURE PHA EXTRACTION USING PHA-POOR SOLVENTS Monsanto Company (US) 2000-01-26 EP disclosed
WO-1998046783-A1 HIGH TEMPERATURE PHA EXTRACTION USING PHA-POOR SOLVENTS MONSANTO COMPANY (US) 1998-10-22 WO disclosed