SCHEMBL18602764

SCHEMBL18602764

CCN(CC1CC1)C1CCC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ADH1C P00326 2/20 0.35
▸ ADH1A P07327 2/20 0.35
▸ ALOX5 P09917 1/20 0.31
▸ LTA4H P09960 1/20 0.31

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
SCHEMBL13082953 0.95 ADH1A (0.42) ADH1CADH1AALOX5LTA4H
SCHEMBL11638870 0.92 SLC6A2 (0.30) ALOX5
SCHEMBL24379259 0.85 SLC6A2 (0.40) —
SCHEMBL24079843 0.84 MEN1 (0.33) ADH1CADH1A
SCHEMBL24080142 0.81 LTA4H (0.36) ADH1CADH1AALOX5LTA4H
SCHEMBL9290239 0.81 ADH1A (0.41) ADH1CADH1A
SCHEMBL614355 0.81 — —
SCHEMBL12449085 0.79 LTA4H (0.38) ADH1CADH1AALOX5LTA4H
SCHEMBL383574 0.78 ADH1A (0.46) ADH1CADH1ALTA4H
SCHEMBL9289339 0.78 ADH1A (0.46) ADH1CADH1ALTA4H

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-2427425-B1 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS INC (US) 2017-03-08 — — EP disclosed
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