SCHEMBL6568681

SCHEMBL6568681

[Li]C1C(C(C)CC)=Cc2c(C)cccc21

nearest known ligand 0.30

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
SCHEMBL6553517 0.71 CYP1A2 (0.33) TSHR
SCHEMBL5605202 0.70 HTR2C (0.31)
SCHEMBL5890668 0.67
SCHEMBL5889762 0.67
SCHEMBL30108378 0.63 MEN1 (0.30)
Hydrochloric Acid SCHEMBL2511625 0.62
Hydrochloric Acid SCHEMBL31571611 0.62
SCHEMBL5859224 0.61 RAPGEF4 (0.30)
SCHEMBL7593800 0.61 MEN1 (0.34)
SCHEMBL28890907 0.61 MEN1 (0.31)

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-1263764-B1 METHOD OF PREPARING GROUP 14 BRIDGED BISCYCLOPENTADIENYL LIGANDS EXXONMOBIL CHEM PATENTS INC (US) 2004-04-14 EP claimed