SCHEMBL22254875

SCHEMBL22254875

CCN(CC1CC(N)C1)C(C)Cc1ccc(C)cc1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.37
▸ SLC6A4 P31645 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
SCHEMBL25541880 0.85 TP53 (0.38) CYP2D6
SCHEMBL25541876 0.85 TP53 (0.38) CYP2D6
SCHEMBL22255190 0.83 SLC6A4 (0.38) CYP2D6SLC6A4
SCHEMBL22255182 0.83 SLC6A4 (0.38) CYP2D6SLC6A4
SCHEMBL22254884 0.82 SLC6A4 (0.44) CYP2D6SLC6A4
SCHEMBL16383691 0.78 SLC6A4 (0.40) CYP2D6SLC6A4
SCHEMBL22254534 0.75 ROCK2 (0.35) CYP2D6
SCHEMBL25532179 0.75 ROCK2 (0.35) CYP2D6
SCHEMBL25541878 0.74 SLC6A4 (0.38) CYP2D6SLC6A4
SCHEMBL25531105 0.73 SIGMAR1 (0.40) CYP2D6

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-2020150385-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 — — WO disclosed
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