SCHEMBL4579149

SCHEMBL4579149

C=C(C)C(=O)OCCc1c(C(=O)O)ccc(O)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
APEX1 P27695 1/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
THRB P10828 1/20 0.40
TSHR P16473 3/20 0.36
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
SELL P14151 1/20 0.33
SELP P16109 1/20 0.33
MCL1 Q07820 2/20 0.32
BCL2L1 Q07817 1/20 0.32
CLCN2 P51788 2/20 0.32
SERPINE1 P05121 1/20 0.32
LCK P06239 1/20 0.31
CSNK2A1 P68400 1/20 0.31
TTR P02766 1/20 0.31

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
SCHEMBL4578227 0.92 POLB (0.46) POLBAPEX1HTTTDP1THRB
SCHEMBL4578717 0.91 POLB (0.48) POLBAPEX1HTTTDP1THRB
SCHEMBL4579606 0.90 POLB (0.50) POLBAPEX1HTTTDP1THRB
SCHEMBL4578579 0.90 POLB (0.50) POLBAPEX1HTTTDP1THRB
SCHEMBL4578008 0.90 POLB (0.50) POLBAPEX1HTTTDP1THRB
SCHEMBL8150164 0.87 TDP1 (0.49) POLBAPEX1HTTTDP1THRB
SCHEMBL27383301 0.82 POLB (0.45) POLBAPEX1HTTTDP1THRB
SCHEMBL1269728 0.82 POLB (0.45) POLBAPEX1HTTTDP1THRB
SCHEMBL1535476 0.81 TDP1 (0.47) POLBAPEX1HTTTDP1THRB
SCHEMBL4579244 0.80 THRB (0.46) TDP1THRBTSHRCA1CA2

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
US-7399569-B2 Method for producing microcapsules, microcapsules, recording material, and heat-sensitive recording material FUJIFILM CORPORATION (JP) 2008-07-15 US disclosed
US-20050187102-A1 Method for producing microcapsules, microcapsules, recording material, and heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2005-08-25 US disclosed
US-6022664-A MIXTURE OF A POLYMERIZABLE VINYL MONOMER AND ORGANIC BORATE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 2000-02-08 US disclosed
EP-0503674-B1 Light-sensitive bistrihalomethyl-s-triazine compound and photopolymerizable composition containing same FUJI PHOTO FILM CO LTD (JP) 1998-06-24 EP disclosed
US-5362874-A Storage stability, discoloration inhibition FUJI PHOTO FILM CO., LTD. (JP) 1994-11-08 US disclosed
EP-0503674-A1 Light-sensitive bistrihalomethyl-S-triazine compound and photopolymerizable composition containing same FUJI PHOTO FILM CO., LTD. (JP) 1992-09-16 EP disclosed