SCHEMBL9406497

SCHEMBL9406497

C=CCCC1CCC(C2CCC(COCCC)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.30

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
SCHEMBL9406493 1.00 TSHR (0.30) TSHR
SCHEMBL9645775 1.00 TSHR (0.30) TSHR
SCHEMBL9647097 0.91 TSHR (0.34) TSHR
SCHEMBL9647083 0.91 TSHR (0.34) TSHR
SCHEMBL9647107 0.91 TSHR (0.34) TSHR
SCHEMBL10536790 0.87 TSHR (0.30) TSHR
SCHEMBL10536786 0.87 TSHR (0.30) TSHR
SCHEMBL9648401 0.87
SCHEMBL9648376 0.87
SCHEMBL9648391 0.87

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-0355552-B1 Alkoxymethyl- and alkenyloxymethyl-cyclohexanes HOFFMANN LA ROCHE (CH) 1994-02-23 EP disclosed
US-5102578-A Electrooptics HOFFMANN-LA ROCHE INC. (US) 1992-04-07 US disclosed