SCHEMBL5212968

SCHEMBL5212968

C=C(C)C(=O)SCC1CSC(c2ccccc2Oc2ccccc2C2SCC(CSC(=O)C(=C)C)S2)S1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HTT P42858 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
SCHEMBL5209239 0.91 HTT (0.34) HTT
SCHEMBL5205191 0.87 HTT (0.33) HTT
SCHEMBL6860975 0.86 HTT (0.32) HTT
SCHEMBL5206258 0.84 HTT (0.32) HTT
SCHEMBL6863193 0.83 MTNR1A (0.37) MAPTMEN1KMT2A
SCHEMBL5209563 0.83 LMNA (0.31) LMNA
SCHEMBL6864643 0.82 HTT (0.34) HTT
SCHEMBL5209496 0.81
SCHEMBL5204761 0.81 ALDH1A1 (0.36) LMNAMAPTNPSR1MEN1KMT2A
SCHEMBL5205053 0.80 GABRP (0.32) HTT

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-1388540-B1 ACRYLIC ESTERS AND USE THEREOF MITSUI CHEMICALS INC (JP) 2007-09-05 EP disclosed
US-6835844-B2 Acrylic esters and use thereof MITSUI CHEMICALS, INC. (JP) 2004-12-28 US disclosed
EP-1388540-A1 ACRYLIC ESTERS AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2004-02-11 EP disclosed