SCHEMBL8897013

SCHEMBL8897013

CCCCC(C)C(CCCC)(CCCC)C(O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
DNM1 Q05193 2/20 0.31
CA2 P00918 1/20 0.30
MAPK1 P28482 1/20 0.30
OPRM1 P35372 1/20 0.30

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
SCHEMBL532845 0.77 FDPS (0.35) FDPSALDH1A1TSHRSMN1; SMN2DNM1
SCHEMBL8898773 0.77 TSHR (0.33) FDPSTSHR
SCHEMBL11416760 0.77 FDPS (0.40) FDPSALDH1A1TSHRSMN1; SMN2DNM1
SCHEMBL28382628 0.77 OPRM1 (0.33) FDPSALDH1A1TSHRSMN1; SMN2DNM1
Ammonia Solution, Strong SCHEMBL27932619 0.76 FDPS (0.34) FDPSALDH1A1TSHRSMN1; SMN2DNM1
SCHEMBL11328501 0.74 FDPS (0.38) FDPSALDH1A1TSHRSMN1; SMN2DNM1
SCHEMBL14840360 0.74 CA1 (0.33) FDPSALDH1A1TSHRSMN1; SMN2DNM1
SCHEMBL28369922 0.74 FDPS (0.39) FDPSALDH1A1TSHRSMN1; SMN2DNM1
SCHEMBL17559998 0.73 FDPS (0.35) FDPSALDH1A1TSHRSMN1; SMN2DNM1
SCHEMBL28240920 0.73 DNM1 (0.33) ALDH1A1TSHRSMN1; SMN2DNM1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114848585-B Improved low-toxicity high-efficiency orthoester miscible medicinal adjuvant, preparation method and local sustained-release drug delivery preparation containing adjuvant 安徽大学 2023-03-28 CN claimed
CN-114848585-A Improved low-toxicity high-efficiency orthoester miscible medicine pharmaceutic adjuvant, preparation method and local sustained-release administration preparation containing adjuvant 安徽大学 2022-08-05 CN claimed
CN-114848585-A Improved low-toxicity high-efficiency orthoester miscible medicine pharmaceutic adjuvant, preparation method and local sustained-release administration preparation containing adjuvant 安徽大学 2022-08-05 CN disclosed
EP-0764674-A2 Fluorination of acetals, ketals and orthoesters EXFLUOR RESEARCH CORPORATION (US) 1997-03-26 EP disclosed
US-5557012-A Fluorination of acetals, ketals and orthoesters EXFLUOR RESEARCH CORPORATION (US) 1996-09-17 US disclosed
US-5543567-A Fluorination of acetals, ketals and orthoesters EXFLUOR RESEARCH CORPORATION (US) 1996-08-06 US disclosed
US-5523496-A Fluorination of acetals, ketals and orthoesters EXFLUOR RESEARCH CORPORATION (US) 1996-06-04 US disclosed
US-5300683-A Perhalogenated polyethers; lubricants; greases; high thermal and oxidative stability EXFLUOR RESEARCH CORPORATION (US) 1994-04-05 US disclosed
US-5202480-A Perfluoropolyethers and perfluorochloropolyether as lubricants, hydraulic fluids, thermal shock and vapor phase soldering fluid; nonflammable; oxidation resistance EXFLUOR RESEARCH CORPORATION (US) 1993-04-13 US disclosed
US-5053536-A Perhalogenated chlorofluoroether compounds or polyethers; lubricants EXFLUOR RESEARCH CORPORATION (US) 1991-10-01 US disclosed
EP-0436629-A1 FLUORINATION OF ACETALS, KETALS AND ORTHOESTERS EXFLUOR RESEARCH CORPORATION (US) 1991-07-17 EP disclosed
WO-1990003410-A1 FLUORINATION OF ACETALS, KETALS AND ORTHOESTERS EXFLUOR RESEARCH CORPORATION (US) 1990-04-05 WO disclosed