SCHEMBL8904347

SCHEMBL8904347

NCC(CCN1CCC(Cc2ccccc2)CC1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 1/20 0.54
CARM1 Q86X55 1/20 0.54
PRMT6 Q96LA8 1/20 0.54
PRMT1 Q99873 1/20 0.54
PRMT8 Q9NR22 1/20 0.54
GRIN2D O15399 1/20 0.54
GRIN3B O60391 1/20 0.54
ADRA1D P25100 1/20 0.54
ADRA1A P35348 1/20 0.54
ADRA1B P35368 1/20 0.54
GRIN1 Q05586 1/20 0.54
GRIN2A Q12879 1/20 0.54
GRIN2B Q13224 1/20 0.54
GRIN2C Q14957 1/20 0.54
GRIN3A Q8TCU5 1/20 0.54
TACR2 P21452 4/20 0.53
CCR5 P51681 1/20 0.51
SLC6A2 P23975 4/20 0.49
SLC6A4 P31645 3/20 0.49
CCR3 P51677 2/20 0.49

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
Hydrochloric Acid SCHEMBL8905872 0.99 PRMT3 (0.53) PRMT3CARM1PRMT6PRMT1PRMT8
Hydrochloric Acid SCHEMBL8904365 0.99 PRMT3 (0.53) PRMT3CARM1PRMT6PRMT1PRMT8
Hydrochloric Acid SCHEMBL10569028 0.88 TACR2 (0.57) GRIN2DGRIN3BADRA1DADRA1AADRA1B
Hydrochloric Acid SCHEMBL8905427 0.85 CARM1 (0.53) CARM1PRMT6GRIN2DGRIN3BADRA1D
SCHEMBL7815365 0.85 PRMT6 (0.59) CARM1PRMT6GRIN2DGRIN3BADRA1D
SCHEMBL8431080 0.83 SIGMAR1 (0.48) TACR2SLC6A4CCR3SLC6A3
Hydrochloric Acid SCHEMBL8904941 0.82 TACR2 (0.52) GRIN2DGRIN3BADRA1DADRA1AADRA1B
Hydrochloric Acid SCHEMBL8911055 0.82 GRIN2B (0.54) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL10569422 0.81 GRIN2B (0.56) GRIN2DGRIN3BADRA1DADRA1AADRA1B
SCHEMBL8292106 0.81 GRIN2B (0.53) PRMT3CARM1PRMT6PRMT1PRMT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5686609-A Aromatic amine compounds, Their method of preparation and pharmaceutical compositions in which they are present SANOFI (FR) 1997-11-11 US disclosed
US-5618938-A Process for preparing stereo isomers of neurokinin receptor antagonists SANOFI (FR) 1997-04-08 US disclosed
EP-0700382-A1 NOVEL N-ARYLALIPHATIC-N-ALKYL-FUNCTIONALISED AMIDES, METHOD FOR THEIR PREPATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI (FR) 1996-03-13 EP disclosed
WO-1995026335-A1 NOVEL N-ARYLALIPHATIC-N-ALKYL-FUNCTIONALISED AMIDES, METHOD FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI (FR) 1995-10-05 WO disclosed
US-5317020-A Neurokinin receiver antagonist as antiinflammatory agents SANOFI (FR) 1994-05-31 US disclosed