SCHEMBL6060198

SCHEMBL6060198

CC=CCCCCC(C)(C)C#N

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
ACLY P53396 1/20 0.34

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
SCHEMBL6059561 0.98 ACLY (0.37) TSHRACLY
SCHEMBL15798724 0.94 TSHR (0.36) TSHRACLY
SCHEMBL2777717 0.94 TSHR (0.36) TSHRACLY
SCHEMBL19969885 0.77 TSHR (0.44) TSHRACLY
SCHEMBL3122938 0.77 TSHR (0.44) TSHRACLY
SCHEMBL9478548 0.77
SCHEMBL11699694 0.75 ACLY (0.40) ACLY
SCHEMBL11699700 0.75 ACLY (0.40) ACLY
SCHEMBL8763241 0.74
SCHEMBL27730372 0.73 TSHR (0.41) TSHRACLY

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
WO-2006125276-A1 PHENYLALKANOL COMPOUNDS ZINGOTX PTY LTD (AU) 2006-11-30 WO disclosed