SCHEMBL9854810

SCHEMBL9854810

CC(C)(C)C(O)Cc1cnco1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
ACACB O00763 1/20 0.32

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
SCHEMBL5960490 0.70 LMNA (0.32)
SCHEMBL26803151 0.68 ACACB (0.34) ACACB
SCHEMBL1016848 0.66
SCHEMBL26399341 0.66 NAMPT (0.36) ACACB
SCHEMBL14255722 0.63 CYP3A4 (0.66) TSHR
SCHEMBL14752590 0.62 FDPS (0.51)
SCHEMBL14663995 0.62 FDPS (0.51)
SCHEMBL3104335 0.62
SCHEMBL3102938 0.62
SCHEMBL5266610 0.62

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-0409418-A1 Heterocyclic tertiary alcohols IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-23 EP disclosed