SCHEMBL4451898

SCHEMBL4451898

CC(S)C(=O)O.CC(S)C(=O)O.OCCCCCCCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.46
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
RNPEP Q9H4A4 1/20 0.42
LMNA P02545 4/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TSHR P16473 1/20 0.39
ACE P12821 1/20 0.39
TDP1 Q9NUW8 3/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 2/20 0.38
PTGS2 P35354 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CAMK2A Q9UQM7 1/20 0.38
HPGD P15428 2/20 0.36
ABCB11 O95342 1/20 0.36
F2 P00734 1/20 0.36

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
1,4-Butanediol SCHEMBL4449579 0.97 RNPEP (0.44) GPR84FFAR1FFAR4RNPEPLMNA
Ethylene Glycol SCHEMBL29686923 0.86 RNPEP (0.48) RNPEPLMNAALDH1A1HSD17B10MEN1
Ethylene Glycol SCHEMBL28854573 0.86 RNPEP (0.48) RNPEPLMNAALDH1A1HSD17B10MEN1
Ethylene Glycol SCHEMBL1171441 0.86 RNPEP (0.48) RNPEPLMNAALDH1A1HSD17B10MEN1
1,6-Hexanediol SCHEMBL8421542 0.83 GPR84 (0.50) GPR84FFAR1FFAR4LMNAALDH1A1
1,6-Hexanediol SCHEMBL15263061 0.83 GPR84 (0.50) GPR84FFAR1FFAR4RNPEPLMNA
1,6-Hexanediol SCHEMBL8420383 0.83 GPR84 (0.50) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL31499020 0.81 RNPEP (0.38) RNPEPLMNAALDH1A1HSD17B10KMT2A
Propanol SCHEMBL10646676 0.81 RNPEP (0.44) RNPEPLMNAALDH1A1HSD17B10MEN1
1,6-Hexanediol SCHEMBL15656017 0.81 GPR84 (0.48) GPR84FFAR1FFAR4LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240110071-A1 Ultraviolet-Curable Water-Based Ink, Dispersion, Ultraviolet-Curable Water-Based Composition, and Printed Matter MITSUBISHI CHEMICAL CORPORATION (JP) 2024-04-04 US disclosed
EP-4328246-A1 ULTRAVIOLET-CURABLE AQUEOUS INK, DISPERSION, ULTRAVIOLET-CURABLE AQUEOUS COMPOSITION, AND PRINTED MATTER Mitsubishi Chemical Corporation (JP) 2024-02-28 EP disclosed
US-7569327-B2 Curable polymer compound SHOWDA DENKO K.K. (JP) 2009-08-04 US disclosed
EP-1629046-B1 CURABLE POLYMER COMPOUND SHOWA DENKO KK (JP) 2008-05-14 EP disclosed
US-20070083012-A1 Curable polymer compound SHOWA DENKO K.K. (JP) 2007-04-12 US disclosed
US-20070021571-A1 Curable polymer compound SHOWA DENKO K.K. (JP) 2007-01-25 US disclosed
US-20060041053-A1 Color filter black matrix resist composition and carbon black dispersion composition used for the composition SHOWA DENKO K.K. (JP) 2006-02-23 US disclosed
US-20060036023-A1 Color filter black matrix resist composition SHOWA DENKO K.K. (JP) 2006-02-16 US disclosed
US-20050258406-A1 Black resist composition for color filter SHOWA DENKO K.K. 2005-11-24 US disclosed