SCHEMBL11096093

SCHEMBL11096093

CC(=NO)SCCC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.34
TSHR P16473 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
SCHEMBL11094595 0.77
SCHEMBL11099346 0.77
SCHEMBL8721595 0.77
SCHEMBL11095110 0.75 ALDH1A1 (0.39)
SCHEMBL3074484 0.73
SCHEMBL11097018 0.72 CYP1A2 (0.41) CYP1A2TSHR
SCHEMBL15396135 0.70 CYP2C19 (0.40) CYP1A2TSHR
SCHEMBL27891877 0.68 CYP1A2 (0.38) CYP1A2TSHR
SCHEMBL12263868 0.67 CYP1A2 (0.39) CYP1A2
SCHEMBL1478263 0.66

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-4454134-A INSECTICIDES, MITICIDES UNION CARBIDE CORPORATION (US) 1984-06-12 US disclosed