SCHEMBL7757981

SCHEMBL7757981

C[C](C)CCOOC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL9752433 0.80 BTN3A1 (0.35) TSHRTDP1
SCHEMBL28514773 0.76 TSHR (0.50) TSHRTDP1
SCHEMBL19118007 0.75 ALDH1A1 (0.37) TSHRTDP1
SCHEMBL8849712 0.72 TSHR (0.39) TSHRTDP1
SCHEMBL3236579 0.72
SCHEMBL9752510 0.72
SCHEMBL27455313 0.71 TSHR (0.44) TSHRTDP1
SCHEMBL3073380 0.71 TSHR (0.44) TSHRTDP1
Hydrogen Peroxide SCHEMBL28108245 0.70 TSHR (0.37) TSHRTDP1
SCHEMBL1682418 0.69 TSHR (0.41) TSHRTDP1

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-0850927-B1 Novel oxalic acid peroxide compositions and their uses ATOFINA CHEM INC (US) 2001-03-14 EP disclosed
US-5866712-A POLYMERIZATION AND CURING CATALYSTS ELF ATOCHEM NORTH AMERICA, INC. (US) 1999-02-02 US disclosed
EP-0850927-A1 Novel oxalic acid peroxide compositions and uses ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-07-01 EP disclosed