SCHEMBL1499261

SCHEMBL1499261

CC=CCc1c(N)c(C)c(N)c(C2CCCCC2)c1C1CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.33
NOS2 P35228 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
SCHEMBL4535927 0.83 NOS1 (0.36) NOS1NOS2
SCHEMBL3424341 0.82 NOS1 (0.37) NOS1NOS2
SCHEMBL3423940 0.80 CNR1 (0.32)
SCHEMBL3424791 0.78 CNR1 (0.33)
SCHEMBL1499188 0.78 CNR1 (0.36) NOS1NOS2
SCHEMBL1499208 0.76
SCHEMBL19119100 0.76
SCHEMBL3426325 0.76 CNR1 (0.35) NOS1NOS2
SCHEMBL3396579 0.76 CNR1 (0.32)
SCHEMBL19119096 0.75 CNR1 (0.39)

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
JP-2011506453-A 2011-03-03 JP claimed
EP-2245123-A2 ALKYLATED 1,3 BENZENEDIAMINE COMPOUNDS AND METHODS FOR PRODUCING SAME Chemtura Corporation (US) 2010-11-03 EP claimed
WO-2009076091-A2 ALKYLATED 1,3 BENZENEDIAMINE COMPOUNDS AND METHODS FOR PRODUCING SAME CHEMTURA CORPORATION (US) 2009-06-18 WO claimed