SCHEMBL7689537

SCHEMBL7689537

CCC(CN=NCC(CC)C(=N)N)C(=N)N

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL2943980 0.81
SCHEMBL6231661 0.74
SCHEMBL3844302 0.74 NOS3 (0.32)
SCHEMBL1127413 0.74 NOS3 (0.32)
SCHEMBL7356322 0.74
SCHEMBL7356315 0.72
Hydrochloric Acid SCHEMBL337401 0.72 NOS3 (0.31)
Hydrochloric Acid SCHEMBL641826 0.72 NOS3 (0.31)
SCHEMBL22202136 0.72
Hydrochloric Acid SCHEMBL2807165 0.72 NOS3 (0.31)

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-2002024795-A1 THERMOPLASTIC ELASTOMERS AND POLYMERS DERIVED FROM RECYCLED RUBBER AND PLASTICS UNIVERSITY OF MASSACHUSETTS (US) 2002-03-28 WO claimed