SCHEMBL4655335

SCHEMBL4655335

CC[C](CC(C)(C)C)CC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL463159 0.93 TSHR (0.38) TSHRTDP1
SCHEMBL11590426 0.82 TSHR (0.30) TSHRTDP1
SCHEMBL6293924 0.81 TSHR (0.36) TSHRTDP1
SCHEMBL1986410 0.69
SCHEMBL4682302 0.69 CYP2D6 (0.32)
SCHEMBL270702 0.67
SCHEMBL12902998 0.67
SCHEMBL11309012 0.67
SCHEMBL8583585 0.67 TSHR (0.33) TSHRTDP1
SCHEMBL72671 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1986598-A1 UV FILTER CAPSULES COMPRISING AN AMINOSUBSTITUTED HYDROXYBENZOPHENONE Merck Patent GmbH (DE) 2008-11-05 EP disclosed
WO-2007093252-A1 UV FILTER CAPSULES COMPRISING AN AMINOSUBSTITUTED HYDROXYBENZOPHENONE MERCK PATENT GMBH (DE) 2007-08-23 WO disclosed