SCHEMBL6704468

SCHEMBL6704468

CN(C)CCN1C(=O)Cc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.61
SLC6A4 P31645 3/20 0.61
HTR7 P34969 13/20 0.54
HTR1A P08908 6/20 0.54
DRD2 P14416 6/20 0.54
LMNA P02545 4/20 0.54
MAPT P10636 4/20 0.54
DRD3 P35462 4/20 0.54
HTR6 P50406 3/20 0.54
DRD5 P21918 3/20 0.54
ALDH1A1 P00352 2/20 0.54
CHRM2 P08172 2/20 0.54
DRD1 P21728 2/20 0.54
SLC6A2 P23975 2/20 0.54
HTR2A P28223 2/20 0.54
ADRA1A P35348 2/20 0.54
OPRM1 P35372 2/20 0.54
DRD4 P21917 2/20 0.54
HTR3E A5X5Y0 1/20 0.54
SLC22A2 O15244 1/20 0.54

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
SCHEMBL12682781 0.91 HTR7 (0.68) HRH1SLC6A4HTR7HTR1ADRD2
SCHEMBL28284590 0.86 SLC6A4 (0.65) HRH1SLC6A4HTR7HTR1ADRD2
SCHEMBL2676272 0.86 HRH1 (0.72) HRH1SLC6A4HTR7HTR1ADRD2
SCHEMBL8719935 0.83 HTR7 (0.50) HRH1SLC6A4HTR7HTR1ADRD2
SCHEMBL21257673 0.82 HRH1 (0.56) HRH1SLC6A4HTR7HTR1ADRD2
Hydrochloric Acid SCHEMBL1821160 0.82 HTR7 (0.49) HRH1SLC6A4HTR7HTR1ADRD2
SCHEMBL8240109 0.81 HTR7 (0.57) HTR7HTR1ADRD2DRD3DRD5
SCHEMBL11850017 0.81 HRH1 (0.70) HRH1SLC6A4HTR7HTR1ADRD2
SCHEMBL24603093 0.80 HRH1 (0.44) HRH1SLC6A4HTR7HTR1ADRD2
SCHEMBL216078 0.80 HRH1 (0.44) HRH1SLC6A4HTR7HTR1ADRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040142924-A1 6-Phenylpyridyl-2-amine derivatives useful as NOS inhibitors PFIZER INC 2004-07-22 US disclosed
EP-0946512-B1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES USEFUL AS NOS INHIBITORS PFIZER (US) 2003-10-08 EP disclosed
CN-1117077-C 6-phenylpyridyl-2-amine derivatives useful as NOS inhibitors PFIZER (US) 2003-08-06 CN disclosed
US-20020103227-A1 6-Phenylpyridyl-2-amine derivatives useful as NOS inhibitors LOWE JOHN A (US) 2002-08-01 US disclosed
US-20020032191-A1 6-phenylpyridyl-2-amine derivatives useful as NOS inhibitors LOWE JOHN A (US) 2002-03-14 US disclosed
US-6235750-B1 NITRIC OXIDE SYNTHASE INHIBITOR PFIZER INC 2001-05-22 US disclosed
CN-1239952-A 6-phenylpyridyl-2-amine derivatives useful as NOS inhibitors PFIZER (US) 1999-12-29 CN disclosed
EP-0946512-A1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES USEFUL AS NOS INHIBITORS PFIZER INC. (US) 1999-10-06 EP disclosed
WO-1998024766-A1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES USEFUL AS NOS INHIBITORS PFIZER INC. (US) 1998-06-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020032191-A1 6-phenylpyridyl-2-amine derivatives useful as NOS inhibitors NOS1, NOS2, NOS3 HRH1 1127/4885SLC6A4 380/4885HTR7 351/4885
US-20040142924-A1 6-Phenylpyridyl-2-amine derivatives useful as NOS inhibitors NOS1, NOS2, NOS3 HRH1 1127/4885SLC6A4 380/4885HTR7 351/4885
US-20020103227-A1 6-Phenylpyridyl-2-amine derivatives useful as NOS inhibitors NOS1, NOS2, NOS3 HRH1 1127/4885SLC6A4 380/4885HTR7 351/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.