SCHEMBL13748432

SCHEMBL13748432

CCN(CC)[C@H]1CC[C@@H](C=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ADH1A P07327 5/20 0.38
▸ ADH1C P00326 4/20 0.38
▸ ADH4 P08319 2/20 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
SCHEMBL18155341 0.82 ADH1A (0.41) ADH1AADH1CADH4
SCHEMBL24754603 0.80 ADH1A (0.36) ADH1AADH1CADH4
SCHEMBL9862148 0.80 ADH1C (0.33) ADH1AADH1CADH4
SCHEMBL835196 0.80 — —
SCHEMBL13077351 0.79 ADH1C (0.34) ADH1AADH1C
SCHEMBL23469783 0.76 — —
SCHEMBL11432372 0.75 ALDH1A1 (0.31) —
SCHEMBL11432368 0.75 ALDH1A1 (0.31) —
SCHEMBL12522745 0.73 ADH1A (0.36) ADH1AADH1CADH4
SCHEMBL21734339 0.72 ADH1A (0.36) ADH1AADH1CADH4

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
WO-2009102325-A1 IMIDAZOLYL BIPHENYL IMIDAZOLES AS HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-20 — — WO disclosed
WO-2008021927-A2 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-02-21 — — WO disclosed
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