SCHEMBL16379299

SCHEMBL16379299

CC(C)N1C[C@@H](N)C[C@H]1CN

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 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
SCHEMBL19756447 1.00 HTT (0.30) HTT
SCHEMBL15957778 0.84 — —
SCHEMBL2738329 0.84 — —
SCHEMBL2737390 0.83 — —
SCHEMBL22778652 0.83 — —
SCHEMBL24567605 0.83 — —
SCHEMBL2737429 0.83 — —
SCHEMBL22962141 0.83 — —
SCHEMBL24567808 0.83 — —
SCHEMBL19084876 0.83 — —

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
US-8933018-B2 Boron containing polybasic bacterial efflux pump inhibitors and therapeutic uses thereof REMPEX PHARMACEUTICALS, INC. (US) 2015-01-13 — — US disclosed
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