SCHEMBL6607616

SCHEMBL6607616

OCC1CSC(CSCc2cccc(CSCC3SCC(CO)S3)c2)S1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC11A2 P49281 1/20 0.32
KMT2A Q03164 1/20 0.31
CRBN Q96SW2 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
SCHEMBL6601860 0.88 CRBN (0.30) CRBN
SCHEMBL5211505 0.87 NOS1 (0.33)
SCHEMBL6599956 0.86 CRBN (0.30) CRBN
SCHEMBL6601140 0.82
SCHEMBL5209895 0.80 ESR1 (0.32)
SCHEMBL1402639 0.80 SLC11A2 (0.36) SLC11A2KMT2ACRBN
SCHEMBL5209203 0.79 GBA1 (0.31)
SCHEMBL5208390 0.79 KMT2A (0.31) KMT2A
SCHEMBL5209810 0.78 CYP1A2 (0.30) KMT2A
SCHEMBL5209646 0.77 CYP1A2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1388540-A1 ACRYLIC ESTERS AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2004-02-11 EP disclosed