SCHEMBL8550414

SCHEMBL8550414

CC=CCC1COCCNC1=O

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.38

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
SCHEMBL9092767 1.00 NOS2 (0.38) NOS2
SCHEMBL8550351 0.81 NOS2 (0.38) NOS2
SCHEMBL8549021 0.75 NOS2 (0.47) NOS2
SCHEMBL9093089 0.75 NOS2 (0.47) NOS2
SCHEMBL18628330 0.71
SCHEMBL8554141 0.71
SCHEMBL4687009 0.67 NOS2 (0.39) NOS2
SCHEMBL8592596 0.66 NOS2 (0.45) NOS2
SCHEMBL8592599 0.66 NOS2 (0.45) NOS2
SCHEMBL9093413 0.65 NOS2 (0.41) NOS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0824523-A1 NITRIC OXIDE SYNTHASE INHIBITORS DERIVED FROM CYCLIC AMIDINES G.D. Searle & Co. (US) 1998-02-25 EP disclosed
WO-1996035677-A1 NITRIC OXIDE SYNTHASE INHIBITORS DERIVED FROM CYCLIC AMIDINES G.D. SEARLE & CO. (US) 1996-11-14 WO disclosed