SCHEMBL12028633

SCHEMBL12028633

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

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
SCHEMBL8530500 0.75 TSHR (0.33) TSHRTDP1
SCHEMBL672974 0.75 TSHR (0.33) TSHRTDP1
SCHEMBL9488071 0.74 TSHR (0.38) TSHRTDP1
SCHEMBL10454220 0.69 TSHR (0.46) TSHRTDP1
SCHEMBL10454218 0.69 TSHR (0.46) TSHRTDP1
SCHEMBL2821815 0.69 TSHR (0.46) TSHRTDP1
SCHEMBL32688063 0.69 TSHR (0.46) TSHRTDP1
SCHEMBL29158128 0.69 TSHR (0.33) TSHRTDP1
Amylene Hydrate SCHEMBL26103077 0.67 TSHR (0.47) TSHRTDP1
SCHEMBL12239356 0.65 TSHR (0.35) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2399570-A1 Polyether-Modified Polysiloxane Containing a Perfluoropolyether Group and Its Production Method Shin-Etsu Chemical Co., Ltd. (JP) 2011-12-28 EP disclosed