SCHEMBL20047052

SCHEMBL20047052

C#CCN1CC(C)SC(C)C1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
MAOB P27338 2/20 0.30
MAOA P21397 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
SCHEMBL17148729 0.78
SCHEMBL31275518 0.73 SIGMAR1 (0.44) TSHR
SCHEMBL22561533 0.73 TSHR (0.35) TSHRMAOBMAOA
SCHEMBL17136154 0.73 TSHR (0.35) TSHRMAOBMAOA
SCHEMBL15700605 0.73 TSHR (0.35) TSHRMAOBMAOA
SCHEMBL7519293 0.73 SIGMAR1 (0.44) TSHR
SCHEMBL31089138 0.70
SCHEMBL21670221 0.70 MAOB (0.31) TSHRMAOB
SCHEMBL24443744 0.69
SCHEMBL31275530 0.68 BCHE (0.36) MAOBMAOA

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-2018067615-A1 COMPOUNDS, DEVICES, AND USES THEREOF SIGILON THERAPEUTICS, INC. (US) 2018-04-12 WO disclosed