Nemazoline

Nemazoline

SCHEMBL4630344

Cc1ccccc1CC1=NCCN1.Nc1c(Cl)cc(CC2=NCCN2)cc1Cl

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTR1B P28222 7/20 0.49
▸ HTR1D P28221 6/20 0.49
▸ ADRA2A P08913 3/20 0.49
▸ ADRA2B P18089 3/20 0.49
▸ ADRA2C P18825 3/20 0.49
▸ ADRA1A P35348 3/20 0.49
▸ ADRA1D P25100 2/20 0.49
▸ ADRA1B P35368 2/20 0.49
▸ TAAR1 Q96RJ0 8/20 0.49
▸ CYP2D6 P10635 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ MAPK1 P28482 2/20 0.46
▸ HTR1A P08908 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ OPRM1 P35372 1/20 0.46
▸ NISCH Q9Y2I1 1/20 0.46
▸ NFKB1 P19838 1/20 0.46

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
Nemazoline SCHEMBL4629757 0.87 TAAR1 (0.50) HTR1BHTR1DADRA2AADRA2BADRA2C
Nemazoline SCHEMBL953212 0.84 TAAR1 (0.53) HTR1BHTR1DADRA2AADRA2BADRA2C
Nemazoline SCHEMBL636058 0.83 TAAR1 (0.54) HTR1BHTR1DADRA2AADRA2BADRA2C
SCHEMBL953620 0.83 TAAR1 (0.68) HTR1BHTR1DADRA2AADRA2BADRA2C
SCHEMBL4629569 0.75 RAD52 (0.61) HTR1BHTR1DADRA2AADRA2BADRA2C
SCHEMBL954827 0.74 TAAR1 (0.68) HTR1DADRA2AADRA2BADRA2CADRA1A
SCHEMBL4986025 0.72 TAAR1 (0.56) HTR1BHTR1DADRA2AADRA2BADRA2C
SCHEMBL26078511 0.72 TAAR1 (0.65) HTR1BHTR1DADRA2AADRA2BADRA2C
SCHEMBL26078507 0.72 HTR1D (0.57) HTR1BHTR1DADRA2AADRA2BADRA2C
SCHEMBL26078452 0.72 HTR1D (0.68) HTR1BHTR1DADRA2AADRA2BADRA2C

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-1981497-A2 USE OF SUBSTITUTED 2-IMIDAZOLE OF IMIDAZOLINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-10-22 — — EP disclosed
WO-2007085557-A2 USE OF SUBSTITUTED 2-IMIDAZOLE OF IMIDAZOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-02 — — WO disclosed
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