SCHEMBL26413192

SCHEMBL26413192

CC(C)CC(C)(CN)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.33

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
SCHEMBL5932813 0.74
SCHEMBL28967871 0.74 TSHR (0.32)
SCHEMBL18769387 0.74
SCHEMBL24723754 0.71 CYP2D6 (0.37) CYP2D6
SCHEMBL10551 0.71
SCHEMBL3833786 0.69
SCHEMBL598088 0.69
SCHEMBL5792114 0.69
SCHEMBL21465937 0.69
SCHEMBL3798601 0.67

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-RE49687-E1 Thienopyrimidine and thienopyridine compounds and methods of use thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2023-10-10 US disclosed