SCHEMBL7666377

SCHEMBL7666377

CC(C)Oc1cc(CC(O)N2CCN(CCc3ccccc3)CC2)ccc1-c1cccc(N)n1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 12/20 0.52
NOS3 P29474 11/20 0.52
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
ADRA1D P25100 4/20 0.44
ADRA1A P35348 4/20 0.44
ADRA1B P35368 4/20 0.44
NOS2 P35228 5/20 0.42
EBP Q15125 2/20 0.38
SIGMAR1 Q99720 2/20 0.38
TMEM97 Q5BJF2 1/20 0.38
HTR1A P08908 1/20 0.38
DRD2 P14416 1/20 0.38
HTR2A P28223 1/20 0.38
EBPL Q9BY08 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
SCHEMBL6699624 0.90 NOS1 (0.60) NOS1NOS3CHRM2CHRM4ADRA1D
SCHEMBL6699620 0.85 NOS1 (0.52) NOS1NOS3CHRM2CHRM4ADRA1D
SCHEMBL6701981 0.83 NOS1 (0.51) NOS1NOS3CHRM2CHRM4ADRA1D
SCHEMBL7583752 0.80 NOS1 (0.48) NOS1NOS3CHRM2CHRM4ADRA1D
SCHEMBL7483828 0.79 NOS1 (0.64) NOS1NOS3CHRM2CHRM4EBP
SCHEMBL6700030 0.79 NOS1 (0.58) NOS1NOS3CHRM2CHRM4NOS2
SCHEMBL6703642 0.78 NOS1 (0.56) NOS1NOS3CHRM2CHRM4NOS2
SCHEMBL6698798 0.77 NOS1 (0.55) NOS1NOS3CHRM2CHRM4NOS2
SCHEMBL7483824 0.77 NOS1 (0.53) NOS1NOS3CHRM2CHRM4ADRA1D
SCHEMBL6702761 0.75 NOS1 (0.60) NOS1NOS3CHRM2CHRM4NOS2

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-6362195-B1 INHIBITOR OF NITRIC OXIDE SYNTHASE; CENTRAL NERVOUS SYSTEM DISORDERS PFIZER INC. 2002-03-26 US disclosed