SCHEMBL10896236

SCHEMBL10896236

CCC(CC)(CC)C(O)O

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.35
TDP1 Q9NUW8 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
SCHEMBL10824166 0.83 FDPS (0.31) TSHR
SCHEMBL7047457 0.83 DPP4 (0.35) TSHRTDP1
SCHEMBL14094800 0.76 TSHR (0.33) TSHR
SCHEMBL2729444 0.76 FDPS (0.33) TSHR
SCHEMBL17201784 0.74 FDPS (0.32)
SCHEMBL4006333 0.74 TSHR (0.36) TSHR
SCHEMBL10892870 0.74 TSHR (0.41) TSHRTDP1
SCHEMBL7680803 0.73 GGPS1 (0.40) TSHR
SCHEMBL11038674 0.72 TSHR (0.33) TSHR
SCHEMBL31329336 0.72 TSHR (0.33) TSHR

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-0082832-B1 RADIATION AND HEAT CURABLE COMPOSITIONS COMPRISING ISOCYANURIC ACID-ACROLEIN DERIVATIVES MONSANTO COMPANY (US) 1986-02-26 EP disclosed