SCHEMBL7159046

SCHEMBL7159046

CC(C)(CO)CC(O)C(C)(C)CO

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
PTGS1 P23219 1/20 0.31
KCNH2 Q12809 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
SCHEMBL6565254 0.81 TSHR (0.46) TSHR
SCHEMBL23716977 0.77 TSHR (0.31) TSHR
SCHEMBL7606636 0.77 CYP2C19 (0.31) TSHR
SCHEMBL1003448 0.75
SCHEMBL638379 0.75
SCHEMBL4817611 0.75
SCHEMBL1967660 0.75
SCHEMBL713526 0.74 TSHR (0.38) TSHRPTGS1KCNH2
SCHEMBL19506932 0.74
SCHEMBL31553297 0.74 TSHR (0.32) TSHRPTGS1KCNH2

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
US-6545119-B2 Magnetic particles in polyesterurethane binder TOYO BOSEKI KABUSHIKI KAISHA (JP) 2003-04-08 US disclosed
EP-1035145-A2 Magnetic recording media and thermoplastic polyurethane resins therefor Toyo Boseki Kabushiki Kaisha (JP) 2000-09-13 EP disclosed