SCHEMBL9254075

SCHEMBL9254075

Cc1cc(C)nc(CCCCCCN)c1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 10/20 0.53
NOS3 P29474 8/20 0.50
NOS1 P29475 8/20 0.50
HRH1 P35367 1/20 0.41

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
SCHEMBL9313998 0.98 NOS2 (0.54) NOS2NOS3NOS1
SCHEMBL9427715 0.84 NOS2 (0.47) NOS2NOS3NOS1
SCHEMBL16228218 0.83 NOS2 (0.58) NOS2NOS3NOS1
SCHEMBL8330656 0.81 NOS2 (0.77) NOS2NOS3NOS1
SCHEMBL13040577 0.81 NOS2 (0.68) NOS2NOS3NOS1
Hydrochloric Acid SCHEMBL8192143 0.80 NOS2 (0.75) NOS2NOS3NOS1
SCHEMBL10144472 0.78 NOS2 (0.52) NOS2NOS3NOS1
SCHEMBL15470594 0.76 NOS2 (0.46) NOS2NOS3NOS1
SCHEMBL2231028 0.76 NOS2 (0.55) NOS2NOS3NOS1
SCHEMBL943293 0.76 NOS2 (0.50) NOS2NOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5395834-A Antiarthritic agents or cardiovascular disorders ADIR ET COMPAGNIE (FR) 1995-03-07 US disclosed
US-5393775-A Administering a (2-chromanyl)alkylcarboxylic acid for disorders connected with peroxidation processes ADIR ET COMPAGNIE (FR) 1995-02-28 US disclosed
US-5315017-A Peroxidation and eicosanoid biosynthesis inhibition ADIR ET COMPAGNIE (FR) 1994-05-24 US disclosed