SCHEMBL5209723

SCHEMBL5209723

OCC1CSC(c2cccc(C3SCC(CO)S3)c2)S1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.32

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
SCHEMBL6862816 0.87 SLC18A3 (0.34)
SCHEMBL5212503 0.85 GABRP (0.37)
SCHEMBL5204843 0.84 GABRP (0.31)
SCHEMBL6863029 0.82 HTR2C (0.38) HTR2C
SCHEMBL5205366 0.82
SCHEMBL6864202 0.78 KDM1A (0.36)
SCHEMBL5213356 0.78 ALDH1A1 (0.30)
SCHEMBL6860853 0.77 MAPT (0.35) HTR2C
SCHEMBL6862850 0.77 MAPT (0.36) HTR2C
SCHEMBL5207532 0.76 HTR2C (0.30) HTR2C

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
EP-1388540-B1 ACRYLIC ESTERS AND USE THEREOF MITSUI CHEMICALS INC (JP) 2007-09-05 EP disclosed
EP-1388540-A1 ACRYLIC ESTERS AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2004-02-11 EP disclosed